3-[(cyclopentylamino)methyl]-1-pentylpyridin-2-one

C16H26N2O — CID 82526710

IUPAC3-[(cyclopentylamino)methyl]-1-pentylpyridin-2-one
SMILESCCCCCn1cccc(CNC2CCCC2)c1=O
InChIInChI=1S/C16H26N2O/c1-2-3-6-11-18-12-7-8-14(16(18)19)13-17-15-9-4-5-10-15/h7-8,12,15,17H,2-6,9-11,13H2,1H3
InChIKeyFFGPPZOGUKSATI-UHFFFAOYSA-N
MW262.40 g/mol
LogP3.07
Rot. Bonds7

About 3-[(cyclopentylamino)methyl]-1-pentylpyridin-2-one

3-[(cyclopentylamino)methyl]-1-pentylpyridin-2-one (PubChem CID 82526710) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 3-[(cyclopentylamino)methyl]-1-pentylpyridin-2-one.

Molecular Properties

Compound Name3-[(cyclopentylamino)methyl]-1-pentylpyridin-2-one
PubChem CID82526710
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name3-[(cyclopentylamino)methyl]-1-pentylpyridin-2-one
SMILESCCCCCn1cccc(CNC2CCCC2)c1=O
InChIInChI=1S/C16H26N2O/c1-2-3-6-11-18-12-7-8-14(16(18)19)13-17-15-9-4-5-10-15/h7-8,12,15,17H,2-6,9-11,13H2,1H3
InChIKeyFFGPPZOGUKSATI-UHFFFAOYSA-N
XLogP3.07
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 3-[(cyclopentylamino)methyl]-1-pentylpyridin-2-one 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

N-[(1-heptylpyrrol-2-yl)methyl]cyclopropanamine
CID 66402783
3-[(butan-2-ylamino)methyl]-1-pentylpyridin-2-one
CID 82526711
1-pentyl-3-(sulfanylmethyl)pyridin-2-one
CID 82526701
3-[(2-methoxyethylamino)methyl]-1-pentylpyridin-2-one
CID 82526709
1-cyclopentyl-3-[(cyclopropylamino)methyl]pyridin-2-one
CID 82526601
3-iodo-1-pentylpyridin-2-one
CID 79785003
3-amino-1-pentylpyridin-2-one
CID 62102446
N-[(1-ethylpyrrol-2-yl)methyl]cyclohexanamine
CID 66411275
N-[(1-ethylpyrrol-2-yl)methyl]cyclooctanamine
CID 66410893
3-(butylaminomethyl)-1-cyclopentylpyridin-2-one
CID 82526600
2-butyl-4-[(cyclopentylamino)methyl]-6-methylpyridazin-3-one
CID 82442927
N-[(1-octylimidazol-2-yl)methyl]cyclopropanamine
CID 55048995

Frequently Asked Questions

What is the IUPAC name of 3-[(cyclopentylamino)methyl]-1-pentylpyridin-2-one?
The IUPAC name of 3-[(cyclopentylamino)methyl]-1-pentylpyridin-2-one (CID 82526710) is 3-[(cyclopentylamino)methyl]-1-pentylpyridin-2-one.
What is the SMILES notation for 3-[(cyclopentylamino)methyl]-1-pentylpyridin-2-one?
The canonical SMILES for 3-[(cyclopentylamino)methyl]-1-pentylpyridin-2-one is CCCCCn1cccc(CNC2CCCC2)c1=O.
What is the InChIKey of 3-[(cyclopentylamino)methyl]-1-pentylpyridin-2-one?
The InChIKey is FFGPPZOGUKSATI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-2-3-6-11-18-12-7-8-14(16(18)19)13-17-15-9-4-5-10-15/h7-8,12,15,17H,2-6,9-11,13H2,1H3.
What are the key properties of 3-[(cyclopentylamino)methyl]-1-pentylpyridin-2-one?
3-[(cyclopentylamino)methyl]-1-pentylpyridin-2-one has a molecular weight of 262.40 g/mol, XLogP of 3.07, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(cyclopentylamino)methyl]-1-pentylpyridin-2-one is sourced from PubChem (CID 82526710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).