5-methyl-N-naphthalen-1-yl-1,2-oxazole-4-carboxamide

C15H12N2O2 — CID 850302

IUPAC5-methyl-N-naphthalen-1-yl-1,2-oxazole-4-carboxamide
SMILESCc1oncc1C(=O)Nc1cccc2ccccc12
InChIInChI=1S/C15H12N2O2/c1-10-13(9-16-19-10)15(18)17-14-8-4-6-11-5-2-3-7-12(11)14/h2-9H,1H3,(H,17,18)
InChIKeyRCEUQZGLCXALTM-UHFFFAOYSA-N
MW252.27 g/mol
LogP3.39
Rot. Bonds2

About 5-methyl-N-naphthalen-1-yl-1,2-oxazole-4-carboxamide

5-methyl-N-naphthalen-1-yl-1,2-oxazole-4-carboxamide (PubChem CID 850302) has the molecular formula C15H12N2O2 and a molecular weight of 252.27 g/mol. Its IUPAC name is 5-methyl-N-naphthalen-1-yl-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound Name5-methyl-N-naphthalen-1-yl-1,2-oxazole-4-carboxamide
PubChem CID850302
Molecular FormulaC15H12N2O2
Molecular Weight252.27 g/mol
Exact Mass252.09
IUPAC Name5-methyl-N-naphthalen-1-yl-1,2-oxazole-4-carboxamide
SMILESCc1oncc1C(=O)Nc1cccc2ccccc12
InChIInChI=1S/C15H12N2O2/c1-10-13(9-16-19-10)15(18)17-14-8-4-6-11-5-2-3-7-12(11)14/h2-9H,1H3,(H,17,18)
InChIKeyRCEUQZGLCXALTM-UHFFFAOYSA-N
XLogP3.39
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Leflunomide
CID 3899
3,5-dimethyl-N-naphthalen-2-yl-1,2-oxazole-4-carboxamide
CID 770347
5-methyl-N-(2-naphthyl)-4-isoxazolecarboxamide
CID 850303
T6893643
CID 850846
N-[5-[(3,5-dimethylbenzoyl)amino]-2-methylphenyl]-5-methyl-1,2-oxazole-4-carboxamide
CID 122189928
5-Methyl-N-[2-(trifluoromethyl)phenyl]isoxazole-4-carboxamide
CID 21912858
5-Methyl-N-(3-(trifluoromethyl)phenyl)isoxazole-4-carboxamide
CID 7314718
N-[5-[[2-(2-fluorophenyl)acetyl]amino]-2-methylphenyl]-5-methyl-1,2-oxazole-4-carboxamide
CID 122189921
5-methyl-N-[2-methyl-5-[[2-(4-phenylphenyl)acetyl]amino]phenyl]-1,2-oxazole-4-carboxamide
CID 122189926
5-methyl-N-[2-methyl-5-[(4-phenylbenzoyl)amino]phenyl]-1,2-oxazole-4-carboxamide
CID 122189929
5-methyl-N-[2-methyl-5-[[3-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1,2-oxazole-4-carboxamide
CID 122189934
N-[5-[(2-fluorophenyl)carbamoylamino]-2-methylphenyl]-5-methyl-1,2-oxazole-4-carboxamide
CID 122189936

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-naphthalen-1-yl-1,2-oxazole-4-carboxamide?
The IUPAC name of 5-methyl-N-naphthalen-1-yl-1,2-oxazole-4-carboxamide (CID 850302) is 5-methyl-N-naphthalen-1-yl-1,2-oxazole-4-carboxamide.
What is the SMILES notation for 5-methyl-N-naphthalen-1-yl-1,2-oxazole-4-carboxamide?
The canonical SMILES for 5-methyl-N-naphthalen-1-yl-1,2-oxazole-4-carboxamide is Cc1oncc1C(=O)Nc1cccc2ccccc12.
What is the InChIKey of 5-methyl-N-naphthalen-1-yl-1,2-oxazole-4-carboxamide?
The InChIKey is RCEUQZGLCXALTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O2/c1-10-13(9-16-19-10)15(18)17-14-8-4-6-11-5-2-3-7-12(11)14/h2-9H,1H3,(H,17,18).
What are the key properties of 5-methyl-N-naphthalen-1-yl-1,2-oxazole-4-carboxamide?
5-methyl-N-naphthalen-1-yl-1,2-oxazole-4-carboxamide has a molecular weight of 252.27 g/mol, XLogP of 3.39, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-naphthalen-1-yl-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 850302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).