[(1S,2R)-2-[(dimethylamino)methyl]cyclopentyl]methanamine

C9H20N2 — CID 84716624

IUPAC[(1S,2R)-2-[(dimethylamino)methyl]cyclopentyl]methanamine
SMILESCN(C)C[C@@H]1CCC[C@@H]1CN
InChIInChI=1S/C9H20N2/c1-11(2)7-9-5-3-4-8(9)6-10/h8-9H,3-7,10H2,1-2H3/t8-,9+/m1/s1
InChIKeyKMBJFINXECFLHJ-BDAKNGLRSA-N
MW156.27 g/mol
LogP0.92
Rot. Bonds3

About [(1S,2R)-2-[(dimethylamino)methyl]cyclopentyl]methanamine

[(1S,2R)-2-[(dimethylamino)methyl]cyclopentyl]methanamine (PubChem CID 84716624) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is [(1S,2R)-2-[(dimethylamino)methyl]cyclopentyl]methanamine.

Molecular Properties

Compound Name[(1S,2R)-2-[(dimethylamino)methyl]cyclopentyl]methanamine
PubChem CID84716624
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC Name[(1S,2R)-2-[(dimethylamino)methyl]cyclopentyl]methanamine
SMILESCN(C)C[C@@H]1CCC[C@@H]1CN
InChIInChI=1S/C9H20N2/c1-11(2)7-9-5-3-4-8(9)6-10/h8-9H,3-7,10H2,1-2H3/t8-,9+/m1/s1
InChIKeyKMBJFINXECFLHJ-BDAKNGLRSA-N
XLogP0.92
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [(1S,2R)-2-[(dimethylamino)methyl]cyclopentyl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [(1S,2R)-2-[(dimethylamino)methyl]cyclopentyl]methanamine?
The IUPAC name of [(1S,2R)-2-[(dimethylamino)methyl]cyclopentyl]methanamine (CID 84716624) is [(1S,2R)-2-[(dimethylamino)methyl]cyclopentyl]methanamine.
What is the SMILES notation for [(1S,2R)-2-[(dimethylamino)methyl]cyclopentyl]methanamine?
The canonical SMILES for [(1S,2R)-2-[(dimethylamino)methyl]cyclopentyl]methanamine is CN(C)C[C@@H]1CCC[C@@H]1CN.
What is the InChIKey of [(1S,2R)-2-[(dimethylamino)methyl]cyclopentyl]methanamine?
The InChIKey is KMBJFINXECFLHJ-BDAKNGLRSA-N. The full InChI is InChI=1S/C9H20N2/c1-11(2)7-9-5-3-4-8(9)6-10/h8-9H,3-7,10H2,1-2H3/t8-,9+/m1/s1.
What are the key properties of [(1S,2R)-2-[(dimethylamino)methyl]cyclopentyl]methanamine?
[(1S,2R)-2-[(dimethylamino)methyl]cyclopentyl]methanamine has a molecular weight of 156.27 g/mol, XLogP of 0.92, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S,2R)-2-[(dimethylamino)methyl]cyclopentyl]methanamine is sourced from PubChem (CID 84716624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).