3-methyl-N-[4-[(3-methyl-1,2-oxazole-5-carbonyl)amino]cyclohexyl]-1,2-oxazole-5-carboxamide

C16H20N4O4 — CID 127423482

IUPAC3-methyl-N-[4-[(3-methyl-1,2-oxazole-5-carbonyl)amino]cyclohexyl]-1,2-oxazole-5-carboxamide
SMILESCc1cc(C(=O)NC2CCC(NC(=O)c3cc(C)no3)CC2)on1
InChIInChI=1S/C16H20N4O4/c1-9-7-13(23-19-9)15(21)17-11-3-5-12(6-4-11)18-16(22)14-8-10(2)20-24-14/h7-8,11-12H,3-6H2,1-2H3,(H,17,21)(H,18,22)
InChIKeyLAFCSNZFJOAVHB-UHFFFAOYSA-N
MW332.36 g/mol
LogP1.75
Rot. Bonds4

About 3-methyl-N-[4-[(3-methyl-1,2-oxazole-5-carbonyl)amino]cyclohexyl]-1,2-oxazole-5-carboxamide

3-methyl-N-[4-[(3-methyl-1,2-oxazole-5-carbonyl)amino]cyclohexyl]-1,2-oxazole-5-carboxamide (PubChem CID 127423482) has the molecular formula C16H20N4O4 and a molecular weight of 332.36 g/mol. Its IUPAC name is 3-methyl-N-[4-[(3-methyl-1,2-oxazole-5-carbonyl)amino]cyclohexyl]-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound Name3-methyl-N-[4-[(3-methyl-1,2-oxazole-5-carbonyl)amino]cyclohexyl]-1,2-oxazole-5-carboxamide
PubChem CID127423482
Molecular FormulaC16H20N4O4
Molecular Weight332.36 g/mol
Exact Mass332.15
IUPAC Name3-methyl-N-[4-[(3-methyl-1,2-oxazole-5-carbonyl)amino]cyclohexyl]-1,2-oxazole-5-carboxamide
SMILESCc1cc(C(=O)NC2CCC(NC(=O)c3cc(C)no3)CC2)on1
InChIInChI=1S/C16H20N4O4/c1-9-7-13(23-19-9)15(21)17-11-3-5-12(6-4-11)18-16(22)14-8-10(2)20-24-14/h7-8,11-12H,3-6H2,1-2H3,(H,17,21)(H,18,22)
InChIKeyLAFCSNZFJOAVHB-UHFFFAOYSA-N
XLogP1.75
TPSA110.26 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.36
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 3-methyl-N-[4-[(3-methyl-1,2-oxazole-5-carbonyl)amino]cyclohexyl]-1,2-oxazole-5-carboxamide with MolForge

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Related Compounds

3-methyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]-1,2-oxazole-5-carboxamide
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3-methyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]-1,2-oxazole-5-carboxamide
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3-methyl-N-[1-[(2R)-oxolane-2-carbonyl]piperidin-4-yl]-1,2-oxazole-5-carboxamide
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N-(4-methylcyclohexyl)-3-(4-methylphenyl)-1,2-oxazole-5-carboxamide
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N-(2-cyanocyclopentyl)-3-methyl-1,2-oxazole-5-carboxamide
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N-[1-(4-cyano-5,6-dimethylpyridazin-3-yl)piperidin-4-yl]-3-methyl-1,2-oxazole-5-carboxamide
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1-methyl-2-[(3-methyl-1,2-oxazole-5-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 82760450
N-cyclopentyl-3-methoxy-1,2-oxazole-5-carboxamide
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3-methyl-N-[1-[4-(trifluoromethyl)pyrimidin-2-yl]piperidin-4-yl]-1,2-oxazole-5-carboxamide
CID 47089197
N-[1-(2-cyano-3-fluorophenyl)piperidin-4-yl]-3-methyl-1,2-oxazole-5-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[4-[(3-methyl-1,2-oxazole-5-carbonyl)amino]cyclohexyl]-1,2-oxazole-5-carboxamide?
The IUPAC name of 3-methyl-N-[4-[(3-methyl-1,2-oxazole-5-carbonyl)amino]cyclohexyl]-1,2-oxazole-5-carboxamide (CID 127423482) is 3-methyl-N-[4-[(3-methyl-1,2-oxazole-5-carbonyl)amino]cyclohexyl]-1,2-oxazole-5-carboxamide.
What is the SMILES notation for 3-methyl-N-[4-[(3-methyl-1,2-oxazole-5-carbonyl)amino]cyclohexyl]-1,2-oxazole-5-carboxamide?
The canonical SMILES for 3-methyl-N-[4-[(3-methyl-1,2-oxazole-5-carbonyl)amino]cyclohexyl]-1,2-oxazole-5-carboxamide is Cc1cc(C(=O)NC2CCC(NC(=O)c3cc(C)no3)CC2)on1.
What is the InChIKey of 3-methyl-N-[4-[(3-methyl-1,2-oxazole-5-carbonyl)amino]cyclohexyl]-1,2-oxazole-5-carboxamide?
The InChIKey is LAFCSNZFJOAVHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O4/c1-9-7-13(23-19-9)15(21)17-11-3-5-12(6-4-11)18-16(22)14-8-10(2)20-24-14/h7-8,11-12H,3-6H2,1-2H3,(H,17,21)(H,18,22).
What are the key properties of 3-methyl-N-[4-[(3-methyl-1,2-oxazole-5-carbonyl)amino]cyclohexyl]-1,2-oxazole-5-carboxamide?
3-methyl-N-[4-[(3-methyl-1,2-oxazole-5-carbonyl)amino]cyclohexyl]-1,2-oxazole-5-carboxamide has a molecular weight of 332.36 g/mol, XLogP of 1.75, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[4-[(3-methyl-1,2-oxazole-5-carbonyl)amino]cyclohexyl]-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 127423482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).