N-(2-phenylcyclohexyl)-1-oxa-8-azaspiro[4.5]decane-8-carboxamide

C21H30N2O2 — CID 156607968

IUPACN-(2-phenylcyclohexyl)-1-oxa-8-azaspiro[4.5]decane-8-carboxamide
SMILESO=C(NC1CCCCC1c1ccccc1)N1CCC2(CCCO2)CC1
InChIInChI=1S/C21H30N2O2/c24-20(23-14-12-21(13-15-23)11-6-16-25-21)22-19-10-5-4-9-18(19)17-7-2-1-3-8-17/h1-3,7-8,18-19H,4-6,9-16H2,(H,22,24)
InChIKeyHOSIVQJHTOYOAF-UHFFFAOYSA-N
MW342.48 g/mol
LogP4.07
Rot. Bonds2

About N-(2-phenylcyclohexyl)-1-oxa-8-azaspiro[4.5]decane-8-carboxamide

N-(2-phenylcyclohexyl)-1-oxa-8-azaspiro[4.5]decane-8-carboxamide (PubChem CID 156607968) has the molecular formula C21H30N2O2 and a molecular weight of 342.48 g/mol. Its IUPAC name is N-(2-phenylcyclohexyl)-1-oxa-8-azaspiro[4.5]decane-8-carboxamide.

Molecular Properties

Compound NameN-(2-phenylcyclohexyl)-1-oxa-8-azaspiro[4.5]decane-8-carboxamide
PubChem CID156607968
Molecular FormulaC21H30N2O2
Molecular Weight342.48 g/mol
Exact Mass342.23
IUPAC NameN-(2-phenylcyclohexyl)-1-oxa-8-azaspiro[4.5]decane-8-carboxamide
SMILESO=C(NC1CCCCC1c1ccccc1)N1CCC2(CCCO2)CC1
InChIInChI=1S/C21H30N2O2/c24-20(23-14-12-21(13-15-23)11-6-16-25-21)22-19-10-5-4-9-18(19)17-7-2-1-3-8-17/h1-3,7-8,18-19H,4-6,9-16H2,(H,22,24)
InChIKeyHOSIVQJHTOYOAF-UHFFFAOYSA-N
XLogP4.07
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.48
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[[(1R,2S)-2-phenylcyclopentyl]carbamoyl]piperidine-4-carboxylic acid
CID 122012024
1-[(2-phenylcyclopentyl)carbamoyl]piperidine-4-carboxylic acid
CID 122001822
1-[(2-phenylcyclopentyl)carbamoyl]piperidine-3-carboxylic acid
CID 122001829
2-[methyl-[1-[[(1R,2S)-2-phenylcyclopentyl]carbamoyl]azepan-4-yl]amino]acetic acid
CID 122012035
1-oxa-9-azaspiro[4.6]undecan-9-yl-(2-pyridin-3-ylcyclohexyl)methanone
CID 155957956
[(2S)-2-phenylcyclohexyl]urea
CID 141176309
N-[(1S,2S)-2-phenylcyclopentyl]cyclohexanecarboxamide
CID 67394032
3-methyl-1-[(2-phenyloxolan-3-yl)carbamoyl]pyrrolidine-3-carboxylic acid
CID 122004919
N-cyclopropyl-1-oxa-7-azaspiro[4.4]nonane-7-carboxamide
CID 131650418
1-amino-N-(2-phenylcyclopentyl)cyclopropane-1-carboxamide
CID 119783047
2-methyl-N-[(1R)-2-phenylcyclohexyl]propanamide
CID 170769324
6-fluoro-N-(2-phenylcyclopropyl)spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxamide
CID 75051608

Frequently Asked Questions

What is the IUPAC name of N-(2-phenylcyclohexyl)-1-oxa-8-azaspiro[4.5]decane-8-carboxamide?
The IUPAC name of N-(2-phenylcyclohexyl)-1-oxa-8-azaspiro[4.5]decane-8-carboxamide (CID 156607968) is N-(2-phenylcyclohexyl)-1-oxa-8-azaspiro[4.5]decane-8-carboxamide.
What is the SMILES notation for N-(2-phenylcyclohexyl)-1-oxa-8-azaspiro[4.5]decane-8-carboxamide?
The canonical SMILES for N-(2-phenylcyclohexyl)-1-oxa-8-azaspiro[4.5]decane-8-carboxamide is O=C(NC1CCCCC1c1ccccc1)N1CCC2(CCCO2)CC1.
What is the InChIKey of N-(2-phenylcyclohexyl)-1-oxa-8-azaspiro[4.5]decane-8-carboxamide?
The InChIKey is HOSIVQJHTOYOAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H30N2O2/c24-20(23-14-12-21(13-15-23)11-6-16-25-21)22-19-10-5-4-9-18(19)17-7-2-1-3-8-17/h1-3,7-8,18-19H,4-6,9-16H2,(H,22,24).
What are the key properties of N-(2-phenylcyclohexyl)-1-oxa-8-azaspiro[4.5]decane-8-carboxamide?
N-(2-phenylcyclohexyl)-1-oxa-8-azaspiro[4.5]decane-8-carboxamide has a molecular weight of 342.48 g/mol, XLogP of 4.07, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylcyclohexyl)-1-oxa-8-azaspiro[4.5]decane-8-carboxamide is sourced from PubChem (CID 156607968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).