1-N-(3-methylcyclopentyl)propane-1,2-diamine

C9H20N2 — CID 114547299

IUPAC1-N-(3-methylcyclopentyl)propane-1,2-diamine
SMILESCC(N)CNC1CCC(C)C1
InChIInChI=1S/C9H20N2/c1-7-3-4-9(5-7)11-6-8(2)10/h7-9,11H,3-6,10H2,1-2H3
InChIKeyWVVGWBZXQQEURF-UHFFFAOYSA-N
MW156.27 g/mol
LogP1.11
Rot. Bonds3

About 1-N-(3-methylcyclopentyl)propane-1,2-diamine

1-N-(3-methylcyclopentyl)propane-1,2-diamine (PubChem CID 114547299) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is 1-N-(3-methylcyclopentyl)propane-1,2-diamine.

Molecular Properties

Compound Name1-N-(3-methylcyclopentyl)propane-1,2-diamine
PubChem CID114547299
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC Name1-N-(3-methylcyclopentyl)propane-1,2-diamine
SMILESCC(N)CNC1CCC(C)C1
InChIInChI=1S/C9H20N2/c1-7-3-4-9(5-7)11-6-8(2)10/h7-9,11H,3-6,10H2,1-2H3
InChIKeyWVVGWBZXQQEURF-UHFFFAOYSA-N
XLogP1.11
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
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

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Related Compounds

N'-(3-methylcyclopentyl)-2-propan-2-ylpropane-1,3-diamine
CID 114547307
trans-(1S,3S)-N-(2,2-difluoroethyl)-3-methylcyclopentan-1-amine
CID 162591470
1-N-(3-methylcyclopentyl)hexane-1,2-diamine
CID 114547296
(2R)-4-amino-2,5-dimethyl-1-[(3-methylcyclopentyl)amino]hexan-3-one
CID 152877016
N'-(3-methylcyclopentyl)-1-phenylethane-1,2-diamine
CID 114547176
3-amino-N-(3-methylcyclopentyl)butanamide
CID 114546157
N-(2-ethylhexyl)-3-methylcyclopentan-1-amine
CID 64500388
1-N-(3-methylcyclopentyl)hexane-1,3-diamine
CID 114547292
3-methyl-N-(2-methyl-3-piperidin-1-ylpropyl)cyclopentan-1-amine
CID 64502363
1-(dimethylamino)-3-[(3-methylcyclopentyl)amino]propan-2-ol
CID 115671208
(2S)-4-[[(1S,3R)-3-methylcyclopentyl]amino]butan-2-ol
CID 124674906
(2R)-4-[[(1S,3S)-3-methylcyclopentyl]amino]butan-2-ol
CID 96784285

Frequently Asked Questions

What is the IUPAC name of 1-N-(3-methylcyclopentyl)propane-1,2-diamine?
The IUPAC name of 1-N-(3-methylcyclopentyl)propane-1,2-diamine (CID 114547299) is 1-N-(3-methylcyclopentyl)propane-1,2-diamine.
What is the SMILES notation for 1-N-(3-methylcyclopentyl)propane-1,2-diamine?
The canonical SMILES for 1-N-(3-methylcyclopentyl)propane-1,2-diamine is CC(N)CNC1CCC(C)C1.
What is the InChIKey of 1-N-(3-methylcyclopentyl)propane-1,2-diamine?
The InChIKey is WVVGWBZXQQEURF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2/c1-7-3-4-9(5-7)11-6-8(2)10/h7-9,11H,3-6,10H2,1-2H3.
What are the key properties of 1-N-(3-methylcyclopentyl)propane-1,2-diamine?
1-N-(3-methylcyclopentyl)propane-1,2-diamine has a molecular weight of 156.27 g/mol, XLogP of 1.11, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(3-methylcyclopentyl)propane-1,2-diamine is sourced from PubChem (CID 114547299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).