Chemical Components in the PDB

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KEN : Summary

Code

KEN

One-letter code

X

Molecule name

N,N-dimethylmethanamine

Systematic names

ProgramVersionName
OpenEye OEToolkits 1.6.1 N,N-dimethylmethanamine

Formula

C3 H9 N

Formal charge

0

Molecular weight

59.11 Da

SMILES

TypeProgramVersionDescriptor
SMILES CACTVS 3.352 CN(C)C
SMILES OpenEye OEToolkits 1.7.0 CN(C)C
Canonical SMILES CACTVS 3.352 CN(C)C
Canonical SMILES OpenEye OEToolkits 1.7.0 CN(C)C

IUPAC InChI

InChI=1S/C3H9N/c1-4(2)3/h1-3H3

IUPAC InChI key

GETQZCLCWQTVFV-UHFFFAOYSA-N
KEN

wwPDB Information

Atom count

13 (4 without Hydrogen)

Polymer type

Bound ligand

Type description

NON-POLYMER

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

2009-11-17

Last modified at

2011-06-04

Status

Released

Obsoleted

Not Assigned