(3-aminopyrrolidin-1-yl)-cyclohexylmethanone

C11H20N2O — CID 59657940

IUPAC(3-aminopyrrolidin-1-yl)-cyclohexylmethanone
SMILESNC1CCN(C(=O)C2CCCCC2)C1
InChIInChI=1S/C11H20N2O/c12-10-6-7-13(8-10)11(14)9-4-2-1-3-5-9/h9-10H,1-8,12H2
InChIKeyFOMMHHOTNLKIKT-UHFFFAOYSA-N
MW196.29 g/mol
LogP1.13
Rot. Bonds1

About (3-aminopyrrolidin-1-yl)-cyclohexylmethanone

(3-aminopyrrolidin-1-yl)-cyclohexylmethanone (PubChem CID 59657940) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is (3-aminopyrrolidin-1-yl)-cyclohexylmethanone.

Molecular Properties

Compound Name(3-aminopyrrolidin-1-yl)-cyclohexylmethanone
PubChem CID59657940
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name(3-aminopyrrolidin-1-yl)-cyclohexylmethanone
SMILESNC1CCN(C(=O)C2CCCCC2)C1
InChIInChI=1S/C11H20N2O/c12-10-6-7-13(8-10)11(14)9-4-2-1-3-5-9/h9-10H,1-8,12H2
InChIKeyFOMMHHOTNLKIKT-UHFFFAOYSA-N
XLogP1.13
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (3-aminopyrrolidin-1-yl)-cyclohexylmethanone 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 (3-aminopyrrolidin-1-yl)-cyclohexylmethanone?
The IUPAC name of (3-aminopyrrolidin-1-yl)-cyclohexylmethanone (CID 59657940) is (3-aminopyrrolidin-1-yl)-cyclohexylmethanone.
What is the SMILES notation for (3-aminopyrrolidin-1-yl)-cyclohexylmethanone?
The canonical SMILES for (3-aminopyrrolidin-1-yl)-cyclohexylmethanone is NC1CCN(C(=O)C2CCCCC2)C1.
What is the InChIKey of (3-aminopyrrolidin-1-yl)-cyclohexylmethanone?
The InChIKey is FOMMHHOTNLKIKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c12-10-6-7-13(8-10)11(14)9-4-2-1-3-5-9/h9-10H,1-8,12H2.
What are the key properties of (3-aminopyrrolidin-1-yl)-cyclohexylmethanone?
(3-aminopyrrolidin-1-yl)-cyclohexylmethanone has a molecular weight of 196.29 g/mol, XLogP of 1.13, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-aminopyrrolidin-1-yl)-cyclohexylmethanone is sourced from PubChem (CID 59657940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).