4-(8-oxo-2-oxa-9-azaspiro[4.5]decan-9-yl)-N-phenylpiperidine-1-carboxamide

C20H27N3O3 — CID 72901458

IUPAC4-(8-oxo-2-oxa-9-azaspiro[4.5]decan-9-yl)-N-phenylpiperidine-1-carboxamide
SMILESO=C(Nc1ccccc1)N1CCC(N2CC3(CCOC3)CCC2=O)CC1
InChIInChI=1S/C20H27N3O3/c24-18-6-9-20(10-13-26-15-20)14-23(18)17-7-11-22(12-8-17)19(25)21-16-4-2-1-3-5-16/h1-5,17H,6-15H2,(H,21,25)
InChIKeyVPZRGWFVRCGSLA-UHFFFAOYSA-N
MW357.45 g/mol
LogP2.71
Rot. Bonds2

About 4-(8-oxo-2-oxa-9-azaspiro[4.5]decan-9-yl)-N-phenylpiperidine-1-carboxamide

4-(8-oxo-2-oxa-9-azaspiro[4.5]decan-9-yl)-N-phenylpiperidine-1-carboxamide (PubChem CID 72901458) has the molecular formula C20H27N3O3 and a molecular weight of 357.45 g/mol. Its IUPAC name is 4-(8-oxo-2-oxa-9-azaspiro[4.5]decan-9-yl)-N-phenylpiperidine-1-carboxamide.

Molecular Properties

Compound Name4-(8-oxo-2-oxa-9-azaspiro[4.5]decan-9-yl)-N-phenylpiperidine-1-carboxamide
PubChem CID72901458
Molecular FormulaC20H27N3O3
Molecular Weight357.45 g/mol
Exact Mass357.21
IUPAC Name4-(8-oxo-2-oxa-9-azaspiro[4.5]decan-9-yl)-N-phenylpiperidine-1-carboxamide
SMILESO=C(Nc1ccccc1)N1CCC(N2CC3(CCOC3)CCC2=O)CC1
InChIInChI=1S/C20H27N3O3/c24-18-6-9-20(10-13-26-15-20)14-23(18)17-7-11-22(12-8-17)19(25)21-16-4-2-1-3-5-16/h1-5,17H,6-15H2,(H,21,25)
InChIKeyVPZRGWFVRCGSLA-UHFFFAOYSA-N
XLogP2.71
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.45
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopropyl-N-(2,6-dimethylphenyl)-3-oxo-2,9-diazaspiro[5.5]undecane-9-carboxamide
CID 70760251
9-[1-[(3,5-difluorophenyl)methyl]piperidin-4-yl]-2-oxa-9-azaspiro[4.5]decan-8-one
CID 72872762
4-(1,9-dioxaspiro[5.5]undecan-4-ylamino)-N-phenylpiperidine-1-carboxamide
CID 70742226
2-cyclopropyl-3-oxo-N-[(1R)-1-phenylpropyl]-2,9-diazaspiro[5.5]undecane-9-carboxamide
CID 70710449
(5R)-N-[3-(4-methylpiperidin-1-yl)phenyl]-2-oxa-7-azaspiro[4.4]nonane-7-carboxamide
CID 99606652
4,4-dimethyl-N-phenylpiperidine-1-carboxamide
CID 110749467
N-(6-chloro-3-pyridinyl)-2-cyclopropyl-3-oxo-2,8-diazaspiro[5.5]undecane-8-carboxamide
CID 70736483
(10aR)-N-(4-methylphenyl)-6-oxo-1,2,4,5,8,9,10,10a-octahydropyrrolo[1,2-a][1,5]diazocine-3-carboxamide
CID 131993361
4-benzyl-N-phenylpiperidine-1-carboxamide
CID 5064762
(6R)-2-cyclopropyl-N-(2,4-difluorophenyl)-3-oxo-2,8-diazaspiro[5.5]undecane-8-carboxamide
CID 97122233
(5R)-N-dibenzofuran-3-yl-2-oxa-7-azaspiro[4.4]nonane-7-carboxamide
CID 97017490
1-(phenylcarbamoyl)piperidine-4-carboxylate
CID 2113074

Frequently Asked Questions

What is the IUPAC name of 4-(8-oxo-2-oxa-9-azaspiro[4.5]decan-9-yl)-N-phenylpiperidine-1-carboxamide?
The IUPAC name of 4-(8-oxo-2-oxa-9-azaspiro[4.5]decan-9-yl)-N-phenylpiperidine-1-carboxamide (CID 72901458) is 4-(8-oxo-2-oxa-9-azaspiro[4.5]decan-9-yl)-N-phenylpiperidine-1-carboxamide.
What is the SMILES notation for 4-(8-oxo-2-oxa-9-azaspiro[4.5]decan-9-yl)-N-phenylpiperidine-1-carboxamide?
The canonical SMILES for 4-(8-oxo-2-oxa-9-azaspiro[4.5]decan-9-yl)-N-phenylpiperidine-1-carboxamide is O=C(Nc1ccccc1)N1CCC(N2CC3(CCOC3)CCC2=O)CC1.
What is the InChIKey of 4-(8-oxo-2-oxa-9-azaspiro[4.5]decan-9-yl)-N-phenylpiperidine-1-carboxamide?
The InChIKey is VPZRGWFVRCGSLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O3/c24-18-6-9-20(10-13-26-15-20)14-23(18)17-7-11-22(12-8-17)19(25)21-16-4-2-1-3-5-16/h1-5,17H,6-15H2,(H,21,25).
What are the key properties of 4-(8-oxo-2-oxa-9-azaspiro[4.5]decan-9-yl)-N-phenylpiperidine-1-carboxamide?
4-(8-oxo-2-oxa-9-azaspiro[4.5]decan-9-yl)-N-phenylpiperidine-1-carboxamide has a molecular weight of 357.45 g/mol, XLogP of 2.71, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(8-oxo-2-oxa-9-azaspiro[4.5]decan-9-yl)-N-phenylpiperidine-1-carboxamide is sourced from PubChem (CID 72901458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).