N-(3-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide

C16H14N2O3 — CID 656290

IUPACN-(3-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
SMILESCc1cccc(NC(=O)Cn2c(=O)oc3ccccc32)c1
InChIInChI=1S/C16H14N2O3/c1-11-5-4-6-12(9-11)17-15(19)10-18-13-7-2-3-8-14(13)21-16(18)20/h2-9H,10H2,1H3,(H,17,19)
InChIKeyANWDNHMDXKBFNR-UHFFFAOYSA-N
MW282.30 g/mol
LogP2.54
Rot. Bonds3

About N-(3-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide

N-(3-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide (PubChem CID 656290) has the molecular formula C16H14N2O3 and a molecular weight of 282.30 g/mol. Its IUPAC name is N-(3-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide.

Molecular Properties

Compound NameN-(3-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
PubChem CID656290
Molecular FormulaC16H14N2O3
Molecular Weight282.30 g/mol
Exact Mass282.10
IUPAC NameN-(3-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
SMILESCc1cccc(NC(=O)Cn2c(=O)oc3ccccc32)c1
InChIInChI=1S/C16H14N2O3/c1-11-5-4-6-12(9-11)17-15(19)10-18-13-7-2-3-8-14(13)21-16(18)20/h2-9H,10H2,1H3,(H,17,19)
InChIKeyANWDNHMDXKBFNR-UHFFFAOYSA-N
XLogP2.54
TPSA64.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Radiprodil
CID 10200813
3-Benzyl-5-methyl-3H-benzooxazol-2-one
CID 1087842
3-(2-Oxopropyl)-2(3H)-benzoxazolone
CID 2744628
5-Methyl-2,3-dihydro-1,3-benzoxazol-2-one
CID 322632
3-benzyl-5-fluorobenzo[d]oxazol-2(3H)-one
CID 52942744
3-(2-oxo-1,3-benzoxazol-3(2H)-yl)propanamide
CID 825415
2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(3-methylphenyl)acetamide
CID 2653640
Acetamide, 2-oxo-2-(1-pyrrolidinyl)-N-(2-methoxyphenyl)-
CID 550974
N-(4-chlorophenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 890994
3-(4-ethoxybenzyl)-1,3-benzoxazol-2(3H)-one
CID 2989877
3-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1,3-benzoxazol-2(3H)-one
CID 2995774
2-(6-chloro-2-oxo-1,3-benzoxazol-3(2H)-yl)-N-(2-methoxybenzyl)acetamide
CID 4335983

Frequently Asked Questions

What is the IUPAC name of N-(3-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide?
The IUPAC name of N-(3-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide (CID 656290) is N-(3-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide.
What is the SMILES notation for N-(3-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide?
The canonical SMILES for N-(3-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide is Cc1cccc(NC(=O)Cn2c(=O)oc3ccccc32)c1.
What is the InChIKey of N-(3-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide?
The InChIKey is ANWDNHMDXKBFNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O3/c1-11-5-4-6-12(9-11)17-15(19)10-18-13-7-2-3-8-14(13)21-16(18)20/h2-9H,10H2,1H3,(H,17,19).
What are the key properties of N-(3-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide?
N-(3-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide has a molecular weight of 282.30 g/mol, XLogP of 2.54, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide is sourced from PubChem (CID 656290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).