1-N-(cyclopentylmethyl)propane-1,2-diamine

C9H20N2 — CID 115196604

IUPAC1-N-(cyclopentylmethyl)propane-1,2-diamine
SMILESCC(N)CNCC1CCCC1
InChIInChI=1S/C9H20N2/c1-8(10)6-11-7-9-4-2-3-5-9/h8-9,11H,2-7,10H2,1H3
InChIKeyQUWARKWGWPFMKL-UHFFFAOYSA-N
MW156.27 g/mol
LogP1.11
Rot. Bonds4

About 1-N-(cyclopentylmethyl)propane-1,2-diamine

1-N-(cyclopentylmethyl)propane-1,2-diamine (PubChem CID 115196604) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is 1-N-(cyclopentylmethyl)propane-1,2-diamine.

Molecular Properties

Compound Name1-N-(cyclopentylmethyl)propane-1,2-diamine
PubChem CID115196604
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC Name1-N-(cyclopentylmethyl)propane-1,2-diamine
SMILESCC(N)CNCC1CCCC1
InChIInChI=1S/C9H20N2/c1-8(10)6-11-7-9-4-2-3-5-9/h8-9,11H,2-7,10H2,1H3
InChIKeyQUWARKWGWPFMKL-UHFFFAOYSA-N
XLogP1.11
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-N-(cyclopentylmethyl)propane-1,2-diamine with MolForge

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

Launch Full Analysis

Related Compounds

2-chloro-N-(cyclopentylmethyl)propan-1-amine
CID 65024059
2-N-[[4-[(2-aminopropylamino)methyl]cyclohexyl]methyl]propane-1,2-diamine
CID 118876014
N-(cyclopentylmethyl)-2-methylbutan-1-amine
CID 43370775
1-(cyclopentylmethylamino)-3-methylbutan-2-ol
CID 115907214
2-chloro-N-(cyclobutylmethyl)propan-1-amine
CID 65460459
methyl (2R)-3-(cycloheptylmethylamino)-2-methylpropanoate
CID 129354214
N-(cyclopentylmethyl)-2-ethylbutan-1-amine
CID 43317342
1-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]propane-1,2-diamine
CID 146382593
(2S)-1-(cyclohexylmethylamino)-5-methylhexan-2-ol
CID 54336883
1-N-(cyclopropylmethyl)-3-methylpentane-1,2-diamine
CID 61150629
N-(cyclopentylmethyl)-3-methylbutan-1-amine
CID 43317373
3-(cyclopentylmethylamino)propane-1,2-diol
CID 60900461

Frequently Asked Questions

What is the IUPAC name of 1-N-(cyclopentylmethyl)propane-1,2-diamine?
The IUPAC name of 1-N-(cyclopentylmethyl)propane-1,2-diamine (CID 115196604) is 1-N-(cyclopentylmethyl)propane-1,2-diamine.
What is the SMILES notation for 1-N-(cyclopentylmethyl)propane-1,2-diamine?
The canonical SMILES for 1-N-(cyclopentylmethyl)propane-1,2-diamine is CC(N)CNCC1CCCC1.
What is the InChIKey of 1-N-(cyclopentylmethyl)propane-1,2-diamine?
The InChIKey is QUWARKWGWPFMKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2/c1-8(10)6-11-7-9-4-2-3-5-9/h8-9,11H,2-7,10H2,1H3.
What are the key properties of 1-N-(cyclopentylmethyl)propane-1,2-diamine?
1-N-(cyclopentylmethyl)propane-1,2-diamine has a molecular weight of 156.27 g/mol, XLogP of 1.11, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(cyclopentylmethyl)propane-1,2-diamine is sourced from PubChem (CID 115196604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).