(6S)-1-methyl-N-(4-methylphenyl)-2-oxo-1,8-diazaspiro[5.5]undecane-8-carboxamide

C18H25N3O2 — CID 97495388

IUPAC(6S)-1-methyl-N-(4-methylphenyl)-2-oxo-1,8-diazaspiro[5.5]undecane-8-carboxamide
SMILESCc1ccc(NC(=O)N2CCC[C@@]3(CCCC(=O)N3C)C2)cc1
InChIInChI=1S/C18H25N3O2/c1-14-6-8-15(9-7-14)19-17(23)21-12-4-11-18(13-21)10-3-5-16(22)20(18)2/h6-9H,3-5,10-13H2,1-2H3,(H,19,23)/t18-/m0/s1
InChIKeyHLVCXICKHBVIDY-SFHVURJKSA-N
MW315.42 g/mol
LogP3.00
Rot. Bonds1

About (6S)-1-methyl-N-(4-methylphenyl)-2-oxo-1,8-diazaspiro[5.5]undecane-8-carboxamide

(6S)-1-methyl-N-(4-methylphenyl)-2-oxo-1,8-diazaspiro[5.5]undecane-8-carboxamide (PubChem CID 97495388) has the molecular formula C18H25N3O2 and a molecular weight of 315.42 g/mol. Its IUPAC name is (6S)-1-methyl-N-(4-methylphenyl)-2-oxo-1,8-diazaspiro[5.5]undecane-8-carboxamide.

Molecular Properties

Compound Name(6S)-1-methyl-N-(4-methylphenyl)-2-oxo-1,8-diazaspiro[5.5]undecane-8-carboxamide
PubChem CID97495388
Molecular FormulaC18H25N3O2
Molecular Weight315.42 g/mol
Exact Mass315.19
IUPAC Name(6S)-1-methyl-N-(4-methylphenyl)-2-oxo-1,8-diazaspiro[5.5]undecane-8-carboxamide
SMILESCc1ccc(NC(=O)N2CCC[C@@]3(CCCC(=O)N3C)C2)cc1
InChIInChI=1S/C18H25N3O2/c1-14-6-8-15(9-7-14)19-17(23)21-12-4-11-18(13-21)10-3-5-16(22)20(18)2/h6-9H,3-5,10-13H2,1-2H3,(H,19,23)/t18-/m0/s1
InChIKeyHLVCXICKHBVIDY-SFHVURJKSA-N
XLogP3.00
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.42
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (6S)-1-methyl-N-(4-methylphenyl)-2-oxo-1,8-diazaspiro[5.5]undecane-8-carboxamide with MolForge

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Related Compounds

(6R)-1-ethyl-N-(4-methylphenyl)-2-oxo-1,8-diazaspiro[5.5]undecane-8-carboxamide
CID 97495478
(6R)-1-methyl-N-(2-methylphenyl)-2-oxo-1,8-diazaspiro[5.5]undecane-8-carboxamide
CID 97495385
N-(4-chlorophenyl)-1-ethyl-2-oxo-1,8-diazaspiro[5.5]undecane-8-carboxamide
CID 134070508
3-methyl-1-[(4-methylphenyl)carbamoyl]piperidine-3-carboxylic acid
CID 63137931
1-N,4-N-bis(4-methylphenyl)piperazine-1,4-dicarboxamide
CID 4055899
3-hydroxy-3-methyl-N-(4-methylphenyl)pyrrolidine-1-carboxamide
CID 103727848
(6S)-1-methyl-8-(6-methylpyridine-3-carbonyl)-1,8-diazaspiro[5.5]undecan-2-one
CID 97495342
4-cyclopropylidene-N-(4-methylphenyl)piperidine-1-carboxamide
CID 121187165
4-hydroxy-1-[(4-methylphenyl)carbamoyl]piperidine-4-carboxylic acid
CID 56878672
1-N-methyl-4-N-(4-methylphenyl)piperazine-1,4-dicarboxamide
CID 23990210
(3S)-3-hydroxy-1-N-(4-methylphenyl)pyrrolidine-1,3-dicarboxamide
CID 99797041
N-(4-methylphenyl)-3-oxo-2-[[(2R)-oxolan-2-yl]methyl]-2,9-diazaspiro[5.5]undecane-9-carboxamide
CID 97119962

Frequently Asked Questions

What is the IUPAC name of (6S)-1-methyl-N-(4-methylphenyl)-2-oxo-1,8-diazaspiro[5.5]undecane-8-carboxamide?
The IUPAC name of (6S)-1-methyl-N-(4-methylphenyl)-2-oxo-1,8-diazaspiro[5.5]undecane-8-carboxamide (CID 97495388) is (6S)-1-methyl-N-(4-methylphenyl)-2-oxo-1,8-diazaspiro[5.5]undecane-8-carboxamide.
What is the SMILES notation for (6S)-1-methyl-N-(4-methylphenyl)-2-oxo-1,8-diazaspiro[5.5]undecane-8-carboxamide?
The canonical SMILES for (6S)-1-methyl-N-(4-methylphenyl)-2-oxo-1,8-diazaspiro[5.5]undecane-8-carboxamide is Cc1ccc(NC(=O)N2CCC[C@@]3(CCCC(=O)N3C)C2)cc1.
What is the InChIKey of (6S)-1-methyl-N-(4-methylphenyl)-2-oxo-1,8-diazaspiro[5.5]undecane-8-carboxamide?
The InChIKey is HLVCXICKHBVIDY-SFHVURJKSA-N. The full InChI is InChI=1S/C18H25N3O2/c1-14-6-8-15(9-7-14)19-17(23)21-12-4-11-18(13-21)10-3-5-16(22)20(18)2/h6-9H,3-5,10-13H2,1-2H3,(H,19,23)/t18-/m0/s1.
What are the key properties of (6S)-1-methyl-N-(4-methylphenyl)-2-oxo-1,8-diazaspiro[5.5]undecane-8-carboxamide?
(6S)-1-methyl-N-(4-methylphenyl)-2-oxo-1,8-diazaspiro[5.5]undecane-8-carboxamide has a molecular weight of 315.42 g/mol, XLogP of 3.00, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6S)-1-methyl-N-(4-methylphenyl)-2-oxo-1,8-diazaspiro[5.5]undecane-8-carboxamide is sourced from PubChem (CID 97495388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).