5-methyl-N-(4-methylcyclohexyl)-1,2-oxazole-3-carboxamide

C12H18N2O2 — CID 17173829

IUPAC5-methyl-N-(4-methylcyclohexyl)-1,2-oxazole-3-carboxamide
SMILESCc1cc(C(=O)NC2CCC(C)CC2)no1
InChIInChI=1S/C12H18N2O2/c1-8-3-5-10(6-4-8)13-12(15)11-7-9(2)16-14-11/h7-8,10H,3-6H2,1-2H3,(H,13,15)
InChIKeyIGPBZHKGMFFTQB-UHFFFAOYSA-N
MW222.29 g/mol
LogP2.29
Rot. Bonds2

About 5-methyl-N-(4-methylcyclohexyl)-1,2-oxazole-3-carboxamide

5-methyl-N-(4-methylcyclohexyl)-1,2-oxazole-3-carboxamide (PubChem CID 17173829) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 5-methyl-N-(4-methylcyclohexyl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(4-methylcyclohexyl)-1,2-oxazole-3-carboxamide
PubChem CID17173829
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name5-methyl-N-(4-methylcyclohexyl)-1,2-oxazole-3-carboxamide
SMILESCc1cc(C(=O)NC2CCC(C)CC2)no1
InChIInChI=1S/C12H18N2O2/c1-8-3-5-10(6-4-8)13-12(15)11-7-9(2)16-14-11/h7-8,10H,3-6H2,1-2H3,(H,13,15)
InChIKeyIGPBZHKGMFFTQB-UHFFFAOYSA-N
XLogP2.29
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-aminocyclohexyl)-5-methyl-1,2-oxazole-3-carboxamide;hydrochloride
CID 119477538
N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-5-methyl-1,2-oxazole-3-carboxamide
CID 47028354
N-[4-(cyclopropylcarbamoyl)phenyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 51299884
N-[(1S,2S)-2-hydroxycyclohexyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 104957455
trans-(1R,2R)-2-[(5-methyl-1,2-oxazole-3-carbonyl)amino]cycloheptane-1-carboxylic acid
CID 97161364
N-[(1R,3R,4R)-3-hydroxy-4-(hydroxymethyl)cyclopentyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 97040038
5-methyl-N-[(3S)-1-(pyrrolidine-1-carbonyl)azepan-3-yl]-1,2-oxazole-3-carboxamide
CID 96576211
N-[4-(4-methylpiperidin-1-yl)cyclohexyl]-5-propan-2-yl-1,2-oxazole-3-carboxamide
CID 119043051
N-(4-methylcyclohexyl)-3-(4-methylphenyl)-1,2-oxazole-5-carboxamide
CID 46427023
N-[4-[dimethylamino(thiophen-2-yl)methyl]cyclohexyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 140543006
N-(1-cyano-4-methylcyclohexyl)-5-methyl-1,2-oxazole-3-carboxamide
CID 66156744
3,5-dimethyl-N-(4-methylcyclohexyl)benzamide
CID 26877405

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(4-methylcyclohexyl)-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-methyl-N-(4-methylcyclohexyl)-1,2-oxazole-3-carboxamide (CID 17173829) is 5-methyl-N-(4-methylcyclohexyl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-methyl-N-(4-methylcyclohexyl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-methyl-N-(4-methylcyclohexyl)-1,2-oxazole-3-carboxamide is Cc1cc(C(=O)NC2CCC(C)CC2)no1.
What is the InChIKey of 5-methyl-N-(4-methylcyclohexyl)-1,2-oxazole-3-carboxamide?
The InChIKey is IGPBZHKGMFFTQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-8-3-5-10(6-4-8)13-12(15)11-7-9(2)16-14-11/h7-8,10H,3-6H2,1-2H3,(H,13,15).
What are the key properties of 5-methyl-N-(4-methylcyclohexyl)-1,2-oxazole-3-carboxamide?
5-methyl-N-(4-methylcyclohexyl)-1,2-oxazole-3-carboxamide has a molecular weight of 222.29 g/mol, XLogP of 2.29, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(4-methylcyclohexyl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 17173829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).