1-[(4-chlorophenyl)methyl]-7-cyclopentyl-1,7-diazaspiro[4.4]nonan-6-one

C19H25ClN2O — CID 67356162

IUPAC1-[(4-chlorophenyl)methyl]-7-cyclopentyl-1,7-diazaspiro[4.4]nonan-6-one
SMILESO=C1N(C2CCCC2)CCC12CCCN2Cc1ccc(Cl)cc1
InChIInChI=1S/C19H25ClN2O/c20-16-8-6-15(7-9-16)14-21-12-3-10-19(21)11-13-22(18(19)23)17-4-1-2-5-17/h6-9,17H,1-5,10-14H2
InChIKeyDMUMVXHCBXGEKL-UHFFFAOYSA-N
MW332.88 g/mol
LogP3.85
Rot. Bonds3

About 1-[(4-chlorophenyl)methyl]-7-cyclopentyl-1,7-diazaspiro[4.4]nonan-6-one

1-[(4-chlorophenyl)methyl]-7-cyclopentyl-1,7-diazaspiro[4.4]nonan-6-one (PubChem CID 67356162) has the molecular formula C19H25ClN2O and a molecular weight of 332.88 g/mol. Its IUPAC name is 1-[(4-chlorophenyl)methyl]-7-cyclopentyl-1,7-diazaspiro[4.4]nonan-6-one.

Molecular Properties

Compound Name1-[(4-chlorophenyl)methyl]-7-cyclopentyl-1,7-diazaspiro[4.4]nonan-6-one
PubChem CID67356162
Molecular FormulaC19H25ClN2O
Molecular Weight332.88 g/mol
Exact Mass332.17
IUPAC Name1-[(4-chlorophenyl)methyl]-7-cyclopentyl-1,7-diazaspiro[4.4]nonan-6-one
SMILESO=C1N(C2CCCC2)CCC12CCCN2Cc1ccc(Cl)cc1
InChIInChI=1S/C19H25ClN2O/c20-16-8-6-15(7-9-16)14-21-12-3-10-19(21)11-13-22(18(19)23)17-4-1-2-5-17/h6-9,17H,1-5,10-14H2
InChIKeyDMUMVXHCBXGEKL-UHFFFAOYSA-N
XLogP3.85
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.88
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-[(4-chlorophenyl)methyl]-7-cyclopentyl-1,7-diazaspiro[4.4]nonan-6-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

3-[4-(4-Chlorobenzyl)piperazin-1-yl]-1-methylpyrrolidine-2,5-dione
CID 580799
1-[(4-Chlorophenyl)methyl]-7-cyclohexyl-1,7-diazaspiro[4.4]nonan-6-one
CID 24758866
1-[(4-Chlorophenyl)methyl]-7-(4-hydroxycyclohexyl)-1,7-diazaspiro[4.4]nonan-6-one
CID 24759743
1-[(4-Chlorophenyl)methyl]-7-(oxan-4-yl)-1,7-diazaspiro[4.4]nonan-6-one
CID 24759744
(2S)-N-[(4-chlorophenyl)methyl]-1-ethyl-5-oxopyrrolidine-2-carboxamide
CID 49864950
1-[(4-Chlorophenyl)methyl]-7-cycloheptyl-1,7-diazaspiro[4.4]nonan-6-one
CID 67355110
5-[2-[(4-Chlorophenyl)methylamino]ethyl]-1-[(1-piperidin-1-ylcyclopentyl)methyl]pyrrolidin-2-one
CID 45488779
(2S)-N-[(2,4-dichlorophenyl)methyl]-N,1-dimethyl-5-oxopyrrolidine-2-carboxamide
CID 49865011
(3S,5S)-1-[(4-chlorophenyl)methyl]-7-cyclohexyl-3-fluoro-1,7-diazaspiro[4.4]nonan-6-one
CID 168284089
N-[(2,4-dichlorophenyl)methyl]-2-methyl-5-oxo-1-propan-2-ylpyrrolidine-2-carboxamide
CID 59303320
(2S)-N-[[2-(aminomethyl)-5-chlorophenyl]methyl]-2-methyl-1-[(2R)-5-oxopyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide
CID 76072702
N-[2-(4-chlorophenyl)ethyl]-1-cyclopentyl-5-oxoprolinamide
CID 3241745

Frequently Asked Questions

What is the IUPAC name of 1-[(4-chlorophenyl)methyl]-7-cyclopentyl-1,7-diazaspiro[4.4]nonan-6-one?
The IUPAC name of 1-[(4-chlorophenyl)methyl]-7-cyclopentyl-1,7-diazaspiro[4.4]nonan-6-one (CID 67356162) is 1-[(4-chlorophenyl)methyl]-7-cyclopentyl-1,7-diazaspiro[4.4]nonan-6-one.
What is the SMILES notation for 1-[(4-chlorophenyl)methyl]-7-cyclopentyl-1,7-diazaspiro[4.4]nonan-6-one?
The canonical SMILES for 1-[(4-chlorophenyl)methyl]-7-cyclopentyl-1,7-diazaspiro[4.4]nonan-6-one is O=C1N(C2CCCC2)CCC12CCCN2Cc1ccc(Cl)cc1.
What is the InChIKey of 1-[(4-chlorophenyl)methyl]-7-cyclopentyl-1,7-diazaspiro[4.4]nonan-6-one?
The InChIKey is DMUMVXHCBXGEKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25ClN2O/c20-16-8-6-15(7-9-16)14-21-12-3-10-19(21)11-13-22(18(19)23)17-4-1-2-5-17/h6-9,17H,1-5,10-14H2.
What are the key properties of 1-[(4-chlorophenyl)methyl]-7-cyclopentyl-1,7-diazaspiro[4.4]nonan-6-one?
1-[(4-chlorophenyl)methyl]-7-cyclopentyl-1,7-diazaspiro[4.4]nonan-6-one has a molecular weight of 332.88 g/mol, XLogP of 3.85, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-chlorophenyl)methyl]-7-cyclopentyl-1,7-diazaspiro[4.4]nonan-6-one is sourced from PubChem (CID 67356162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).