N-(2,5-dimethylphenyl)-10-oxo-1,9-diazaspiro[4.5]decane-1-carboxamide

C17H23N3O2 — CID 163311389

IUPACN-(2,5-dimethylphenyl)-10-oxo-1,9-diazaspiro[4.5]decane-1-carboxamide
SMILESCc1ccc(C)c(NC(=O)N2CCCC23CCCNC3=O)c1
InChIInChI=1S/C17H23N3O2/c1-12-5-6-13(2)14(11-12)19-16(22)20-10-4-8-17(20)7-3-9-18-15(17)21/h5-6,11H,3-4,7-10H2,1-2H3,(H,18,21)(H,19,22)
InChIKeyXHVBKSARKRGTCP-UHFFFAOYSA-N
MW301.39 g/mol
LogP2.58
Rot. Bonds1

About N-(2,5-dimethylphenyl)-10-oxo-1,9-diazaspiro[4.5]decane-1-carboxamide

N-(2,5-dimethylphenyl)-10-oxo-1,9-diazaspiro[4.5]decane-1-carboxamide (PubChem CID 163311389) has the molecular formula C17H23N3O2 and a molecular weight of 301.39 g/mol. Its IUPAC name is N-(2,5-dimethylphenyl)-10-oxo-1,9-diazaspiro[4.5]decane-1-carboxamide.

Molecular Properties

Compound NameN-(2,5-dimethylphenyl)-10-oxo-1,9-diazaspiro[4.5]decane-1-carboxamide
PubChem CID163311389
Molecular FormulaC17H23N3O2
Molecular Weight301.39 g/mol
Exact Mass301.18
IUPAC NameN-(2,5-dimethylphenyl)-10-oxo-1,9-diazaspiro[4.5]decane-1-carboxamide
SMILESCc1ccc(C)c(NC(=O)N2CCCC23CCCNC3=O)c1
InChIInChI=1S/C17H23N3O2/c1-12-5-6-13(2)14(11-12)19-16(22)20-10-4-8-17(20)7-3-9-18-15(17)21/h5-6,11H,3-4,7-10H2,1-2H3,(H,18,21)(H,19,22)
InChIKeyXHVBKSARKRGTCP-UHFFFAOYSA-N
XLogP2.58
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

9-cyclopropyl-N-(2,5-dimethylphenyl)-10-oxo-1,9-diazaspiro[4.5]decane-1-carboxamide
CID 162629050
1-[(2,5-dimethylphenyl)carbamoyl]-2-methylpiperidine-2-carboxylic acid
CID 104597866
(5S)-N-(2,5-dimethylphenyl)-1,3-dioxo-2,7-diazaspiro[4.4]nonane-7-carboxamide
CID 96579065
3-[(2,2-dimethylpyrrolidine-1-carbonyl)amino]-4-methylbenzoic acid
CID 63219197
1-[3-(3,5-dimethylphenyl)propanoyl]-1,9-diazaspiro[4.5]decan-10-one
CID 164699962
1-[(2,5-dimethylphenyl)carbamoyl]-3-methylpiperidine-3-carboxylic acid
CID 63135826
(4aS,8aR)-N-(2,5-dimethylphenyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-2-carboxamide
CID 51943981
N-(2,5-dimethylphenyl)-2-(1-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide
CID 7850304
8-[(2,5-dimethylphenyl)carbamoyl]-2-oxo-1,8-diazaspiro[4.5]decane-4-carboxylic acid
CID 72886739
N-(2,5-dimethylphenyl)-6,6-dimethyl-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide
CID 175977018
N-(2,5-dimethylphenyl)-1-(pyrrolidine-1-carbonyl)cyclopropane-1-carboxamide
CID 108971649
N-(2,5-dimethylphenyl)-1-methylcyclohexane-1-carboxamide
CID 56695193

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethylphenyl)-10-oxo-1,9-diazaspiro[4.5]decane-1-carboxamide?
The IUPAC name of N-(2,5-dimethylphenyl)-10-oxo-1,9-diazaspiro[4.5]decane-1-carboxamide (CID 163311389) is N-(2,5-dimethylphenyl)-10-oxo-1,9-diazaspiro[4.5]decane-1-carboxamide.
What is the SMILES notation for N-(2,5-dimethylphenyl)-10-oxo-1,9-diazaspiro[4.5]decane-1-carboxamide?
The canonical SMILES for N-(2,5-dimethylphenyl)-10-oxo-1,9-diazaspiro[4.5]decane-1-carboxamide is Cc1ccc(C)c(NC(=O)N2CCCC23CCCNC3=O)c1.
What is the InChIKey of N-(2,5-dimethylphenyl)-10-oxo-1,9-diazaspiro[4.5]decane-1-carboxamide?
The InChIKey is XHVBKSARKRGTCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O2/c1-12-5-6-13(2)14(11-12)19-16(22)20-10-4-8-17(20)7-3-9-18-15(17)21/h5-6,11H,3-4,7-10H2,1-2H3,(H,18,21)(H,19,22).
What are the key properties of N-(2,5-dimethylphenyl)-10-oxo-1,9-diazaspiro[4.5]decane-1-carboxamide?
N-(2,5-dimethylphenyl)-10-oxo-1,9-diazaspiro[4.5]decane-1-carboxamide has a molecular weight of 301.39 g/mol, XLogP of 2.58, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethylphenyl)-10-oxo-1,9-diazaspiro[4.5]decane-1-carboxamide is sourced from PubChem (CID 163311389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).