2-methyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)amino]phenyl]benzamide

C18H17N3O2 — CID 112990340

IUPAC2-methyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)amino]phenyl]benzamide
SMILESCc1cc(Nc2ccc(NC(=O)c3ccccc3C)cc2)no1
InChIInChI=1S/C18H17N3O2/c1-12-5-3-4-6-16(12)18(22)20-15-9-7-14(8-10-15)19-17-11-13(2)23-21-17/h3-11H,1-2H3,(H,19,21)(H,20,22)
InChIKeyOAKFGXCLVGEPOU-UHFFFAOYSA-N
MW307.35 g/mol
LogP4.29
Rot. Bonds4

About 2-methyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)amino]phenyl]benzamide

2-methyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)amino]phenyl]benzamide (PubChem CID 112990340) has the molecular formula C18H17N3O2 and a molecular weight of 307.35 g/mol. Its IUPAC name is 2-methyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)amino]phenyl]benzamide.

Molecular Properties

Compound Name2-methyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)amino]phenyl]benzamide
PubChem CID112990340
Molecular FormulaC18H17N3O2
Molecular Weight307.35 g/mol
Exact Mass307.13
IUPAC Name2-methyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)amino]phenyl]benzamide
SMILESCc1cc(Nc2ccc(NC(=O)c3ccccc3C)cc2)no1
InChIInChI=1S/C18H17N3O2/c1-12-5-3-4-6-16(12)18(22)20-15-9-7-14(8-10-15)19-17-11-13(2)23-21-17/h3-11H,1-2H3,(H,19,21)(H,20,22)
InChIKeyOAKFGXCLVGEPOU-UHFFFAOYSA-N
XLogP4.29
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 54.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[(5-methyl-1,2-oxazol-3-yl)amino]phenyl]acetamide
CID 112990326
N-[4-[(4-anilino-6-methylpyrimidin-2-yl)amino]phenyl]-2-methylbenzamide
CID 121032199
N-[5-[(5-methyl-1,2-oxazol-3-yl)amino]-2-pyridinyl]benzamide
CID 113037667
N-[4-[[5-(dimethylamino)pyridazin-3-yl]amino]phenyl]-2-methylbenzamide
CID 122321800
ethyl N-[4-[(5-methyl-1,2-oxazol-3-yl)amino]phenyl]carbamate
CID 112990393
N-[6-(4-bromoanilino)-3-pyridinyl]-2-methylbenzamide
CID 113019208
N-[6-(4-methoxyanilino)pyridazin-3-yl]-2-methylbenzamide
CID 113048288
N-(2,6-dimethylphenyl)-5-[(5-methyl-1,2-oxazol-3-yl)amino]pyridine-2-carboxamide
CID 109198250
2-methyl-N-(4-sulfanylphenyl)benzamide
CID 143459352
N-[6-(4-acetylanilino)-3-pyridinyl]-2-methylbenzamide
CID 113020395
2-[(2R)-1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxopropan-2-yl]oxy-N-phenylbenzamide
CID 41176934
2-iodo-N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]benzamide
CID 1108217

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)amino]phenyl]benzamide?
The IUPAC name of 2-methyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)amino]phenyl]benzamide (CID 112990340) is 2-methyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)amino]phenyl]benzamide.
What is the SMILES notation for 2-methyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)amino]phenyl]benzamide?
The canonical SMILES for 2-methyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)amino]phenyl]benzamide is Cc1cc(Nc2ccc(NC(=O)c3ccccc3C)cc2)no1.
What is the InChIKey of 2-methyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)amino]phenyl]benzamide?
The InChIKey is OAKFGXCLVGEPOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O2/c1-12-5-3-4-6-16(12)18(22)20-15-9-7-14(8-10-15)19-17-11-13(2)23-21-17/h3-11H,1-2H3,(H,19,21)(H,20,22).
What are the key properties of 2-methyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)amino]phenyl]benzamide?
2-methyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)amino]phenyl]benzamide has a molecular weight of 307.35 g/mol, XLogP of 4.29, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)amino]phenyl]benzamide is sourced from PubChem (CID 112990340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).