2-benzamido-N-cyclohexyl-1,3-oxazole-4-carboxamide

C17H19N3O3 — CID 90514925

IUPAC2-benzamido-N-cyclohexyl-1,3-oxazole-4-carboxamide
SMILESO=C(Nc1nc(C(=O)NC2CCCCC2)co1)c1ccccc1
InChIInChI=1S/C17H19N3O3/c21-15(12-7-3-1-4-8-12)20-17-19-14(11-23-17)16(22)18-13-9-5-2-6-10-13/h1,3-4,7-8,11,13H,2,5-6,9-10H2,(H,18,22)(H,19,20,21)
InChIKeyHPARRTFWRHPCQZ-UHFFFAOYSA-N
MW313.36 g/mol
LogP2.99
Rot. Bonds4

About 2-benzamido-N-cyclohexyl-1,3-oxazole-4-carboxamide

2-benzamido-N-cyclohexyl-1,3-oxazole-4-carboxamide (PubChem CID 90514925) has the molecular formula C17H19N3O3 and a molecular weight of 313.36 g/mol. Its IUPAC name is 2-benzamido-N-cyclohexyl-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound Name2-benzamido-N-cyclohexyl-1,3-oxazole-4-carboxamide
PubChem CID90514925
Molecular FormulaC17H19N3O3
Molecular Weight313.36 g/mol
Exact Mass313.14
IUPAC Name2-benzamido-N-cyclohexyl-1,3-oxazole-4-carboxamide
SMILESO=C(Nc1nc(C(=O)NC2CCCCC2)co1)c1ccccc1
InChIInChI=1S/C17H19N3O3/c21-15(12-7-3-1-4-8-12)20-17-19-14(11-23-17)16(22)18-13-9-5-2-6-10-13/h1,3-4,7-8,11,13H,2,5-6,9-10H2,(H,18,22)(H,19,20,21)
InChIKeyHPARRTFWRHPCQZ-UHFFFAOYSA-N
XLogP2.99
TPSA84.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 72717053
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N-[4-(4-cyclohexylpiperazine-1-carbonyl)-1,3-oxazol-2-yl]benzamide
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2-amino-N-cyclohexyl-1,3-oxazole-4-carboxamide
CID 110848950
4-benzamido-N-cyclopentylbenzamide
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2-benzamido-N-(2-pyridin-4-ylethyl)-1,3-oxazole-4-carboxamide
CID 90515066
N-(4-cyclohexylcyclooctyl)benzamide
CID 166761299
2-benzamido-N-(3,4-difluorophenyl)-1,3-oxazole-4-carboxamide
CID 52907899
2-benzamido-N-(3-bromophenyl)-1,3-oxazole-4-carboxamide
CID 90514961
2-benzamido-N-cyclohexyl-1,3-benzothiazole-6-carboxamide
CID 4159999
N-cyclooctylquinoxaline-2-carboxamide
CID 22136387

Frequently Asked Questions

What is the IUPAC name of 2-benzamido-N-cyclohexyl-1,3-oxazole-4-carboxamide?
The IUPAC name of 2-benzamido-N-cyclohexyl-1,3-oxazole-4-carboxamide (CID 90514925) is 2-benzamido-N-cyclohexyl-1,3-oxazole-4-carboxamide.
What is the SMILES notation for 2-benzamido-N-cyclohexyl-1,3-oxazole-4-carboxamide?
The canonical SMILES for 2-benzamido-N-cyclohexyl-1,3-oxazole-4-carboxamide is O=C(Nc1nc(C(=O)NC2CCCCC2)co1)c1ccccc1.
What is the InChIKey of 2-benzamido-N-cyclohexyl-1,3-oxazole-4-carboxamide?
The InChIKey is HPARRTFWRHPCQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O3/c21-15(12-7-3-1-4-8-12)20-17-19-14(11-23-17)16(22)18-13-9-5-2-6-10-13/h1,3-4,7-8,11,13H,2,5-6,9-10H2,(H,18,22)(H,19,20,21).
What are the key properties of 2-benzamido-N-cyclohexyl-1,3-oxazole-4-carboxamide?
2-benzamido-N-cyclohexyl-1,3-oxazole-4-carboxamide has a molecular weight of 313.36 g/mol, XLogP of 2.99, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzamido-N-cyclohexyl-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 90514925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).