1-[1-(aminomethyl)cyclopentyl]-2-cyclopropylethanone

C11H19NO — CID 116601042

IUPAC1-[1-(aminomethyl)cyclopentyl]-2-cyclopropylethanone
SMILESNCC1(C(=O)CC2CC2)CCCC1
InChIInChI=1S/C11H19NO/c12-8-11(5-1-2-6-11)10(13)7-9-3-4-9/h9H,1-8,12H2
InChIKeyQMMGHQCYMHQUQL-UHFFFAOYSA-N
MW181.28 g/mol
LogP1.87
Rot. Bonds4

About 1-[1-(aminomethyl)cyclopentyl]-2-cyclopropylethanone

1-[1-(aminomethyl)cyclopentyl]-2-cyclopropylethanone (PubChem CID 116601042) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is 1-[1-(aminomethyl)cyclopentyl]-2-cyclopropylethanone.

Molecular Properties

Compound Name1-[1-(aminomethyl)cyclopentyl]-2-cyclopropylethanone
PubChem CID116601042
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC Name1-[1-(aminomethyl)cyclopentyl]-2-cyclopropylethanone
SMILESNCC1(C(=O)CC2CC2)CCCC1
InChIInChI=1S/C11H19NO/c12-8-11(5-1-2-6-11)10(13)7-9-3-4-9/h9H,1-8,12H2
InChIKeyQMMGHQCYMHQUQL-UHFFFAOYSA-N
XLogP1.87
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-[1-(aminomethyl)cyclopentyl]-2-cyclopropylethanone 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

1-[1-(aminomethyl)cycloheptyl]-2-cyclobutylethanone
CID 116602062
2-cyclohexyl-1-(1-ethylcyclopentyl)ethanone
CID 114967656
1-[1-(aminomethyl)cyclopentyl]-2-(2-bicyclo[2.2.1]heptanyl)ethanone
CID 116600831
1-[1-(aminomethyl)cyclopentyl]propan-1-one
CID 116600810
1-[1-(aminomethyl)cyclobutyl]propan-1-one
CID 116600219
1-[1-(aminomethyl)cyclobutyl]-2-(1-methylsulfonylpiperidin-3-yl)ethanone
CID 116600281
[1-(aminomethyl)cyclobutyl]-cyclopentylmethanone
CID 116600201
1-[1-(aminomethyl)cyclobutyl]butan-1-one
CID 116600255
2-cyclohexyl-1-[1-(2-methylpropyl)cyclopentyl]ethanone
CID 114967627
[1-(aminomethyl)cyclopentyl]-(4-ethylcyclohexyl)methanone
CID 116600979
1-(aminomethyl)cyclobutane-1-carboxylic acid
CID 23405971
2-[1-[1-(aminomethyl)cycloheptanecarbonyl]piperidin-4-yl]acetic acid
CID 115444228

Frequently Asked Questions

What is the IUPAC name of 1-[1-(aminomethyl)cyclopentyl]-2-cyclopropylethanone?
The IUPAC name of 1-[1-(aminomethyl)cyclopentyl]-2-cyclopropylethanone (CID 116601042) is 1-[1-(aminomethyl)cyclopentyl]-2-cyclopropylethanone.
What is the SMILES notation for 1-[1-(aminomethyl)cyclopentyl]-2-cyclopropylethanone?
The canonical SMILES for 1-[1-(aminomethyl)cyclopentyl]-2-cyclopropylethanone is NCC1(C(=O)CC2CC2)CCCC1.
What is the InChIKey of 1-[1-(aminomethyl)cyclopentyl]-2-cyclopropylethanone?
The InChIKey is QMMGHQCYMHQUQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO/c12-8-11(5-1-2-6-11)10(13)7-9-3-4-9/h9H,1-8,12H2.
What are the key properties of 1-[1-(aminomethyl)cyclopentyl]-2-cyclopropylethanone?
1-[1-(aminomethyl)cyclopentyl]-2-cyclopropylethanone has a molecular weight of 181.28 g/mol, XLogP of 1.87, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(aminomethyl)cyclopentyl]-2-cyclopropylethanone is sourced from PubChem (CID 116601042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).