N-(3-methylphenyl)-2-(1,3-oxazol-4-yl)acetamide

C12H12N2O2 — CID 110686325

IUPACN-(3-methylphenyl)-2-(1,3-oxazol-4-yl)acetamide
SMILESCc1cccc(NC(=O)Cc2cocn2)c1
InChIInChI=1S/C12H12N2O2/c1-9-3-2-4-10(5-9)14-12(15)6-11-7-16-8-13-11/h2-5,7-8H,6H2,1H3,(H,14,15)
InChIKeyDKHYHCICOZAFMW-UHFFFAOYSA-N
MW216.24 g/mol
LogP2.16
Rot. Bonds3

About N-(3-methylphenyl)-2-(1,3-oxazol-4-yl)acetamide

N-(3-methylphenyl)-2-(1,3-oxazol-4-yl)acetamide (PubChem CID 110686325) has the molecular formula C12H12N2O2 and a molecular weight of 216.24 g/mol. Its IUPAC name is N-(3-methylphenyl)-2-(1,3-oxazol-4-yl)acetamide.

Molecular Properties

Compound NameN-(3-methylphenyl)-2-(1,3-oxazol-4-yl)acetamide
PubChem CID110686325
Molecular FormulaC12H12N2O2
Molecular Weight216.24 g/mol
Exact Mass216.09
IUPAC NameN-(3-methylphenyl)-2-(1,3-oxazol-4-yl)acetamide
SMILESCc1cccc(NC(=O)Cc2cocn2)c1
InChIInChI=1S/C12H12N2O2/c1-9-3-2-4-10(5-9)14-12(15)6-11-7-16-8-13-11/h2-5,7-8H,6H2,1H3,(H,14,15)
InChIKeyDKHYHCICOZAFMW-UHFFFAOYSA-N
XLogP2.16
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-methyl-1,2-oxazol-3-yl)-N-(3-methylphenyl)acetamide
CID 110417275
2-[4-(aminomethyl)phenyl]-N-(3-methylphenyl)acetamide
CID 63590654
N-(4-cyanophenyl)-2-(1,3-oxazol-4-yl)acetamide
CID 110686437
2-(1,3-benzodioxol-5-yl)-N-(3-methylphenyl)acetamide
CID 40805167
N-(3-bromo-4-methylphenyl)-3-(1,3-oxazol-4-yl)propanamide
CID 110679078
N-(3-methylphenyl)-2-[2-(1,2,4-oxadiazol-3-yl)ethylamino]acetamide
CID 106401239
2-(2-bromo-4,5-diethoxyphenyl)-N-(3-methylphenyl)acetamide
CID 9039211
[2-(3-methylanilino)-2-oxoethyl] acetate
CID 531943
2-[2-(aminomethyl)-4-methyl-1,3-thiazol-5-yl]-N-(3-methylphenyl)acetamide
CID 94284257
2-(1-methylimidazol-2-yl)sulfanyl-N-(3-methylphenyl)acetamide
CID 712610
2-(3-methylphenyl)-N-phenylacetamide
CID 6470005
N-(3,5-dimethylphenyl)-2-(3-methylphenyl)acetamide
CID 11839743

Frequently Asked Questions

What is the IUPAC name of N-(3-methylphenyl)-2-(1,3-oxazol-4-yl)acetamide?
The IUPAC name of N-(3-methylphenyl)-2-(1,3-oxazol-4-yl)acetamide (CID 110686325) is N-(3-methylphenyl)-2-(1,3-oxazol-4-yl)acetamide.
What is the SMILES notation for N-(3-methylphenyl)-2-(1,3-oxazol-4-yl)acetamide?
The canonical SMILES for N-(3-methylphenyl)-2-(1,3-oxazol-4-yl)acetamide is Cc1cccc(NC(=O)Cc2cocn2)c1.
What is the InChIKey of N-(3-methylphenyl)-2-(1,3-oxazol-4-yl)acetamide?
The InChIKey is DKHYHCICOZAFMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2/c1-9-3-2-4-10(5-9)14-12(15)6-11-7-16-8-13-11/h2-5,7-8H,6H2,1H3,(H,14,15).
What are the key properties of N-(3-methylphenyl)-2-(1,3-oxazol-4-yl)acetamide?
N-(3-methylphenyl)-2-(1,3-oxazol-4-yl)acetamide has a molecular weight of 216.24 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylphenyl)-2-(1,3-oxazol-4-yl)acetamide is sourced from PubChem (CID 110686325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).