9-benzyl-1-[(4-chlorophenyl)methyl]-1,9-diazaspiro[4.5]decan-10-one

C22H25ClN2O — CID 163317012

IUPAC9-benzyl-1-[(4-chlorophenyl)methyl]-1,9-diazaspiro[4.5]decan-10-one
SMILESO=C1N(Cc2ccccc2)CCCC12CCCN2Cc1ccc(Cl)cc1
InChIInChI=1S/C22H25ClN2O/c23-20-10-8-19(9-11-20)17-25-15-5-13-22(25)12-4-14-24(21(22)26)16-18-6-2-1-3-7-18/h1-3,6-11H,4-5,12-17H2
InChIKeyQZLFXOGXZCGHHK-UHFFFAOYSA-N
MW368.91 g/mol
LogP4.50
Rot. Bonds4

About 9-benzyl-1-[(4-chlorophenyl)methyl]-1,9-diazaspiro[4.5]decan-10-one

9-benzyl-1-[(4-chlorophenyl)methyl]-1,9-diazaspiro[4.5]decan-10-one (PubChem CID 163317012) has the molecular formula C22H25ClN2O and a molecular weight of 368.91 g/mol. Its IUPAC name is 9-benzyl-1-[(4-chlorophenyl)methyl]-1,9-diazaspiro[4.5]decan-10-one.

Molecular Properties

Compound Name9-benzyl-1-[(4-chlorophenyl)methyl]-1,9-diazaspiro[4.5]decan-10-one
PubChem CID163317012
Molecular FormulaC22H25ClN2O
Molecular Weight368.91 g/mol
Exact Mass368.17
IUPAC Name9-benzyl-1-[(4-chlorophenyl)methyl]-1,9-diazaspiro[4.5]decan-10-one
SMILESO=C1N(Cc2ccccc2)CCCC12CCCN2Cc1ccc(Cl)cc1
InChIInChI=1S/C22H25ClN2O/c23-20-10-8-19(9-11-20)17-25-15-5-13-22(25)12-4-14-24(21(22)26)16-18-6-2-1-3-7-18/h1-3,6-11H,4-5,12-17H2
InChIKeyQZLFXOGXZCGHHK-UHFFFAOYSA-N
XLogP4.50
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.91
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-[(9-benzyl-10-oxo-1,9-diazaspiro[4.5]decan-1-yl)methyl]phenyl]acetic acid
CID 163311970
4-[[10-oxo-9-(2-phenylethyl)-1,9-diazaspiro[4.5]decan-1-yl]methyl]benzonitrile
CID 162626493
1-[(4-chloro-2-fluorophenyl)methyl]-9-(2-phenylethyl)-1,9-diazaspiro[4.5]decan-10-one
CID 162625681
1-[(2-amino-3-pyridinyl)methyl]-9-benzyl-1,9-diazaspiro[4.5]decan-10-one
CID 162628202
1-benzyl-1-azaspiro[4.4]nonan-9-one
CID 138106111
1-[(2-chloro-3-hydroxyphenyl)methyl]-9-(2-phenylethyl)-1,9-diazaspiro[4.5]decan-10-one
CID 162634689
1-benzyl-7-[(1R)-1-phenylethyl]-1,7-diazaspiro[4.4]nonan-6-one
CID 73013443
(6R)-1-benzyl-1-azaspiro[5.5]undecan-11-one
CID 14866444
9-benzyl-1-[[3-(trifluoromethyl)-1,2,4-oxadiazol-5-yl]methyl]-1,9-diazaspiro[4.5]decan-10-one
CID 163319449
9-benzyl-1-[(3-cyclohexyl-1,2-oxazol-5-yl)methyl]-1,9-diazaspiro[4.5]decan-10-one
CID 163317627
9-benzyl-1-(4-fluoro-3-methylbenzoyl)-1,9-diazaspiro[4.5]decan-10-one
CID 162625491
9-benzyl-N-(4-ethylphenyl)-10-oxo-1,9-diazaspiro[4.5]decane-1-carboxamide
CID 162631678

Frequently Asked Questions

What is the IUPAC name of 9-benzyl-1-[(4-chlorophenyl)methyl]-1,9-diazaspiro[4.5]decan-10-one?
The IUPAC name of 9-benzyl-1-[(4-chlorophenyl)methyl]-1,9-diazaspiro[4.5]decan-10-one (CID 163317012) is 9-benzyl-1-[(4-chlorophenyl)methyl]-1,9-diazaspiro[4.5]decan-10-one.
What is the SMILES notation for 9-benzyl-1-[(4-chlorophenyl)methyl]-1,9-diazaspiro[4.5]decan-10-one?
The canonical SMILES for 9-benzyl-1-[(4-chlorophenyl)methyl]-1,9-diazaspiro[4.5]decan-10-one is O=C1N(Cc2ccccc2)CCCC12CCCN2Cc1ccc(Cl)cc1.
What is the InChIKey of 9-benzyl-1-[(4-chlorophenyl)methyl]-1,9-diazaspiro[4.5]decan-10-one?
The InChIKey is QZLFXOGXZCGHHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25ClN2O/c23-20-10-8-19(9-11-20)17-25-15-5-13-22(25)12-4-14-24(21(22)26)16-18-6-2-1-3-7-18/h1-3,6-11H,4-5,12-17H2.
What are the key properties of 9-benzyl-1-[(4-chlorophenyl)methyl]-1,9-diazaspiro[4.5]decan-10-one?
9-benzyl-1-[(4-chlorophenyl)methyl]-1,9-diazaspiro[4.5]decan-10-one has a molecular weight of 368.91 g/mol, XLogP of 4.50, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-benzyl-1-[(4-chlorophenyl)methyl]-1,9-diazaspiro[4.5]decan-10-one is sourced from PubChem (CID 163317012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).