7-cyclohexyl-2-[(3-hydroxy-4-methoxyphenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one

C22H32N2O3 — CID 72941178

IUPAC7-cyclohexyl-2-[(3-hydroxy-4-methoxyphenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one
SMILESCOc1ccc(CN2CCC3(CCCN(C4CCCCC4)C3=O)C2)cc1O
InChIInChI=1S/C22H32N2O3/c1-27-20-9-8-17(14-19(20)25)15-23-13-11-22(16-23)10-5-12-24(21(22)26)18-6-3-2-4-7-18/h8-9,14,18,25H,2-7,10-13,15-16H2,1H3
InChIKeyKEAQZQYDTYYCEU-UHFFFAOYSA-N
MW372.51 g/mol
LogP3.55
Rot. Bonds4

About 7-cyclohexyl-2-[(3-hydroxy-4-methoxyphenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one

7-cyclohexyl-2-[(3-hydroxy-4-methoxyphenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one (PubChem CID 72941178) has the molecular formula C22H32N2O3 and a molecular weight of 372.51 g/mol. Its IUPAC name is 7-cyclohexyl-2-[(3-hydroxy-4-methoxyphenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one.

Molecular Properties

Compound Name7-cyclohexyl-2-[(3-hydroxy-4-methoxyphenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one
PubChem CID72941178
Molecular FormulaC22H32N2O3
Molecular Weight372.51 g/mol
Exact Mass372.24
IUPAC Name7-cyclohexyl-2-[(3-hydroxy-4-methoxyphenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one
SMILESCOc1ccc(CN2CCC3(CCCN(C4CCCCC4)C3=O)C2)cc1O
InChIInChI=1S/C22H32N2O3/c1-27-20-9-8-17(14-19(20)25)15-23-13-11-22(16-23)10-5-12-24(21(22)26)18-6-3-2-4-7-18/h8-9,14,18,25H,2-7,10-13,15-16H2,1H3
InChIKeyKEAQZQYDTYYCEU-UHFFFAOYSA-N
XLogP3.55
TPSA53.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.51
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 7-cyclohexyl-2-[(3-hydroxy-4-methoxyphenyl)methyl]-2,7-diazaspiro[4.5]decan-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

9-cyclopropyl-1-[(3-hydroxy-4-methoxyphenyl)methyl]-1,9-diazaspiro[4.5]decan-10-one
CID 162628045
(5R)-2-[(5-acetylthiophen-3-yl)methyl]-7-cyclohexyl-2,7-diazaspiro[4.5]decan-6-one
CID 97134259
5-[(4,4-dimethylazepan-1-yl)methyl]-2-methoxyphenol
CID 82981011
(5R)-7-cyclohexyl-2-[[2-(ethylamino)pyrimidin-5-yl]methyl]-2,7-diazaspiro[4.5]decan-6-one
CID 97156512
5-[(4-amino-3,3-dimethylpiperidin-1-yl)methyl]-2-methoxyphenol
CID 120781423
methyl 2-hydroxy-5-[[(5R)-7-methyl-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]methyl]benzoate
CID 95197199
5-[(4-amino-3,3-dimethylpiperidin-1-yl)methyl]-2-methoxyphenol;hydrochloride
CID 120781422
(5S)-7-cyclohexyl-2-[(2-methyl-1,3-thiazol-4-yl)methyl]-2,7-diazaspiro[4.5]decan-6-one
CID 97133364
7-cyclopentyl-2-(5-methoxyfuran-2-carbonyl)-2,7-diazaspiro[4.5]decan-6-one
CID 72928464
7-(cyclohexylmethyl)-2-[(3-hydroxyphenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one
CID 45238508
5-[[4-cyclohexyl-3-(2-hydroxyethyl)piperazin-1-yl]methyl]-2-methoxyphenol
CID 45171109
2-[[4-methoxy-3-(pyrazol-1-ylmethyl)phenyl]methyl]-7-methyl-2,7-diazaspiro[4.5]decan-6-one
CID 45220941

Frequently Asked Questions

What is the IUPAC name of 7-cyclohexyl-2-[(3-hydroxy-4-methoxyphenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one?
The IUPAC name of 7-cyclohexyl-2-[(3-hydroxy-4-methoxyphenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one (CID 72941178) is 7-cyclohexyl-2-[(3-hydroxy-4-methoxyphenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one.
What is the SMILES notation for 7-cyclohexyl-2-[(3-hydroxy-4-methoxyphenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one?
The canonical SMILES for 7-cyclohexyl-2-[(3-hydroxy-4-methoxyphenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one is COc1ccc(CN2CCC3(CCCN(C4CCCCC4)C3=O)C2)cc1O.
What is the InChIKey of 7-cyclohexyl-2-[(3-hydroxy-4-methoxyphenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one?
The InChIKey is KEAQZQYDTYYCEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H32N2O3/c1-27-20-9-8-17(14-19(20)25)15-23-13-11-22(16-23)10-5-12-24(21(22)26)18-6-3-2-4-7-18/h8-9,14,18,25H,2-7,10-13,15-16H2,1H3.
What are the key properties of 7-cyclohexyl-2-[(3-hydroxy-4-methoxyphenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one?
7-cyclohexyl-2-[(3-hydroxy-4-methoxyphenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one has a molecular weight of 372.51 g/mol, XLogP of 3.55, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-cyclohexyl-2-[(3-hydroxy-4-methoxyphenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one is sourced from PubChem (CID 72941178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).