2-[1-(4-methylphenyl)cyclopropanecarbonyl]-2,7-diazaspiro[4.5]decan-6-one

C19H24N2O2 — CID 72879316

IUPAC2-[1-(4-methylphenyl)cyclopropanecarbonyl]-2,7-diazaspiro[4.5]decan-6-one
SMILESCc1ccc(C2(C(=O)N3CCC4(CCCNC4=O)C3)CC2)cc1
InChIInChI=1S/C19H24N2O2/c1-14-3-5-15(6-4-14)19(8-9-19)17(23)21-12-10-18(13-21)7-2-11-20-16(18)22/h3-6H,2,7-13H2,1H3,(H,20,22)
InChIKeyFECICUWETRFASU-UHFFFAOYSA-N
MW312.41 g/mol
LogP2.16
Rot. Bonds2

About 2-[1-(4-methylphenyl)cyclopropanecarbonyl]-2,7-diazaspiro[4.5]decan-6-one

2-[1-(4-methylphenyl)cyclopropanecarbonyl]-2,7-diazaspiro[4.5]decan-6-one (PubChem CID 72879316) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is 2-[1-(4-methylphenyl)cyclopropanecarbonyl]-2,7-diazaspiro[4.5]decan-6-one.

Molecular Properties

Compound Name2-[1-(4-methylphenyl)cyclopropanecarbonyl]-2,7-diazaspiro[4.5]decan-6-one
PubChem CID72879316
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name2-[1-(4-methylphenyl)cyclopropanecarbonyl]-2,7-diazaspiro[4.5]decan-6-one
SMILESCc1ccc(C2(C(=O)N3CCC4(CCCNC4=O)C3)CC2)cc1
InChIInChI=1S/C19H24N2O2/c1-14-3-5-15(6-4-14)19(8-9-19)17(23)21-12-10-18(13-21)7-2-11-20-16(18)22/h3-6H,2,7-13H2,1H3,(H,20,22)
InChIKeyFECICUWETRFASU-UHFFFAOYSA-N
XLogP2.16
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-methylpiperazine-1-carbonyl)-2,7-diazaspiro[4.5]decan-6-one
CID 72937627
(5S)-N-tert-butyl-6-oxo-2,7-diazaspiro[4.5]decane-2-carboxamide
CID 97125831
[3-hydroxy-3-(4-methylphenyl)pyrrolidin-1-yl]-[1-(4-hydroxyphenyl)cyclopropyl]methanone
CID 166280981
[1-(4-methylphenyl)cyclobutyl]-piperidin-1-ylmethanone
CID 146883856
7-methyl-2-(1-phenylcyclopentanecarbonyl)-2,7-diazaspiro[4.5]decan-6-one
CID 72907513
2-(1-ethyl-2,5-dimethylpyrrole-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one
CID 72896595
6-methyl-4-[2-oxo-2-[(5R)-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]ethyl]-1,4-benzoxazin-3-one
CID 97145463
2-(5-methyl-2-phenyl-1H-imidazole-4-carbonyl)-2,7-diazaspiro[4.5]decan-6-one
CID 72926019
2-(3,3,3-trifluoropropanoyl)-2,7-diazaspiro[4.5]decan-6-one
CID 72922471
2-[4-(4-fluorophenyl)oxane-4-carbonyl]-7-methyl-2,7-diazaspiro[4.5]decan-6-one
CID 72848121
(5R)-3-methyl-9-[1-(4-methylphenyl)cyclopropanecarbonyl]-1-oxa-3,9-diazaspiro[4.6]undecan-2-one
CID 95722297
9-(2-methylsulfanylacetyl)-2,9-diazaspiro[5.5]undecan-1-one
CID 98896688

Frequently Asked Questions

What is the IUPAC name of 2-[1-(4-methylphenyl)cyclopropanecarbonyl]-2,7-diazaspiro[4.5]decan-6-one?
The IUPAC name of 2-[1-(4-methylphenyl)cyclopropanecarbonyl]-2,7-diazaspiro[4.5]decan-6-one (CID 72879316) is 2-[1-(4-methylphenyl)cyclopropanecarbonyl]-2,7-diazaspiro[4.5]decan-6-one.
What is the SMILES notation for 2-[1-(4-methylphenyl)cyclopropanecarbonyl]-2,7-diazaspiro[4.5]decan-6-one?
The canonical SMILES for 2-[1-(4-methylphenyl)cyclopropanecarbonyl]-2,7-diazaspiro[4.5]decan-6-one is Cc1ccc(C2(C(=O)N3CCC4(CCCNC4=O)C3)CC2)cc1.
What is the InChIKey of 2-[1-(4-methylphenyl)cyclopropanecarbonyl]-2,7-diazaspiro[4.5]decan-6-one?
The InChIKey is FECICUWETRFASU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-14-3-5-15(6-4-14)19(8-9-19)17(23)21-12-10-18(13-21)7-2-11-20-16(18)22/h3-6H,2,7-13H2,1H3,(H,20,22).
What are the key properties of 2-[1-(4-methylphenyl)cyclopropanecarbonyl]-2,7-diazaspiro[4.5]decan-6-one?
2-[1-(4-methylphenyl)cyclopropanecarbonyl]-2,7-diazaspiro[4.5]decan-6-one has a molecular weight of 312.41 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(4-methylphenyl)cyclopropanecarbonyl]-2,7-diazaspiro[4.5]decan-6-one is sourced from PubChem (CID 72879316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).