N-ethyl-5-methyl-N,3-diphenyl-1,2-oxazole-4-carboxamide

C19H18N2O2 — CID 807628

IUPACN-ethyl-5-methyl-N,3-diphenyl-1,2-oxazole-4-carboxamide
SMILESCCN(C(=O)c1c(-c2ccccc2)noc1C)c1ccccc1
InChIInChI=1S/C19H18N2O2/c1-3-21(16-12-8-5-9-13-16)19(22)17-14(2)23-20-18(17)15-10-6-4-7-11-15/h4-13H,3H2,1-2H3
InChIKeyDEJGVVWXWTXULI-UHFFFAOYSA-N
MW306.37 g/mol
LogP4.32
Rot. Bonds4

About N-ethyl-5-methyl-N,3-diphenyl-1,2-oxazole-4-carboxamide

N-ethyl-5-methyl-N,3-diphenyl-1,2-oxazole-4-carboxamide (PubChem CID 807628) has the molecular formula C19H18N2O2 and a molecular weight of 306.37 g/mol. Its IUPAC name is N-ethyl-5-methyl-N,3-diphenyl-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-ethyl-5-methyl-N,3-diphenyl-1,2-oxazole-4-carboxamide
PubChem CID807628
Molecular FormulaC19H18N2O2
Molecular Weight306.37 g/mol
Exact Mass306.14
IUPAC NameN-ethyl-5-methyl-N,3-diphenyl-1,2-oxazole-4-carboxamide
SMILESCCN(C(=O)c1c(-c2ccccc2)noc1C)c1ccccc1
InChIInChI=1S/C19H18N2O2/c1-3-21(16-12-8-5-9-13-16)19(22)17-14(2)23-20-18(17)15-10-6-4-7-11-15/h4-13H,3H2,1-2H3
InChIKeyDEJGVVWXWTXULI-UHFFFAOYSA-N
XLogP4.32
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Nucleozin
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3-(2-Chlorophenyl)-5-methylisoxazol-4-yl 4-methylpiperazinyl ketone
CID 798832
[3-(2-Chloro-phenyl)-5-methyl-isoxazol-4-yl]-piperidin-1-yl-methanone
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[3-(2,6-Dichloro-phenyl)-5-methyl-isoxazol-4-yl]-piperidin-1-yl-methanone
CID 743794
(5-Methyl-3-phenyl-1,2-oxazol-4-yl)-pyrrolidin-1-ylmethanone
CID 822394
5-Methyl-3-phenyl-6-pyridin-4-yl-[1,2]oxazolo[4,5-c]pyridin-4-one
CID 22015566
5-methyl-3-phenyl-6-(p-[dimethylaminomethyl]phenyl)-isoxazolo[4,5-c]pyridin-4(5H)-one
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1-{[3-(2,6-Dichlorophenyl)-5-methylisoxazol-4-yl]carbonyl}indoline
CID 1160933
3-(2-chlorophenyl)-N-[4-(diethylamino)phenyl]-5-methyl-1,2-oxazole-4-carboxamide
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5-Phenylisoxazol-3-yl 4-phenylpiperazinyl ketone
CID 1250455

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-methyl-N,3-diphenyl-1,2-oxazole-4-carboxamide?
The IUPAC name of N-ethyl-5-methyl-N,3-diphenyl-1,2-oxazole-4-carboxamide (CID 807628) is N-ethyl-5-methyl-N,3-diphenyl-1,2-oxazole-4-carboxamide.
What is the SMILES notation for N-ethyl-5-methyl-N,3-diphenyl-1,2-oxazole-4-carboxamide?
The canonical SMILES for N-ethyl-5-methyl-N,3-diphenyl-1,2-oxazole-4-carboxamide is CCN(C(=O)c1c(-c2ccccc2)noc1C)c1ccccc1.
What is the InChIKey of N-ethyl-5-methyl-N,3-diphenyl-1,2-oxazole-4-carboxamide?
The InChIKey is DEJGVVWXWTXULI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O2/c1-3-21(16-12-8-5-9-13-16)19(22)17-14(2)23-20-18(17)15-10-6-4-7-11-15/h4-13H,3H2,1-2H3.
What are the key properties of N-ethyl-5-methyl-N,3-diphenyl-1,2-oxazole-4-carboxamide?
N-ethyl-5-methyl-N,3-diphenyl-1,2-oxazole-4-carboxamide has a molecular weight of 306.37 g/mol, XLogP of 4.32, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-methyl-N,3-diphenyl-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 807628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).