2-(2-methylphenyl)-N-oxoacetamide

C9H9NO2 — CID 89001397

IUPAC2-(2-methylphenyl)-N-oxoacetamide
SMILESCc1ccccc1CC(=O)N=O
InChIInChI=1S/C9H9NO2/c1-7-4-2-3-5-8(7)6-9(11)10-12/h2-5H,6H2,1H3
InChIKeyBNCSLQNXWOMJLA-UHFFFAOYSA-N
MW163.18 g/mol
LogP1.83
Rot. Bonds2

About 2-(2-methylphenyl)-N-oxoacetamide

2-(2-methylphenyl)-N-oxoacetamide (PubChem CID 89001397) has the molecular formula C9H9NO2 and a molecular weight of 163.18 g/mol. Its IUPAC name is 2-(2-methylphenyl)-N-oxoacetamide.

Molecular Properties

Compound Name2-(2-methylphenyl)-N-oxoacetamide
PubChem CID89001397
Molecular FormulaC9H9NO2
Molecular Weight163.18 g/mol
Exact Mass163.06
IUPAC Name2-(2-methylphenyl)-N-oxoacetamide
SMILESCc1ccccc1CC(=O)N=O
InChIInChI=1S/C9H9NO2/c1-7-4-2-3-5-8(7)6-9(11)10-12/h2-5H,6H2,1H3
InChIKeyBNCSLQNXWOMJLA-UHFFFAOYSA-N
XLogP1.83
TPSA46.50 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.18
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-methylphenyl)acetic acid
CID 67440217
ethane;methyl 2-(2-methylphenyl)acetate
CID 142489189
dichloromethane;2-(2-methylphenyl)acetic acid
CID 174962889
2-(2-methylphenyl)-N-[2-(2-methylphenyl)acetyl]acetamide
CID 140983476
1,2-bis(2-methylphenyl)ethanone
CID 11345119
potassium;hydride;phosphanyl 2-(2-methylphenyl)acetate
CID 174951239
acetic acid;1-ethyl-2-methylbenzene
CID 67948051
2-(2-nitrophenyl)-N-oxoacetamide
CID 174738474
2-methoxyethyl 2-(2-methylphenyl)acetate
CID 78830183
ethyl 2-[[2-(2-methylphenyl)acetyl]amino]acetate
CID 26163301
methyl 3-[(2-methylphenyl)methyl]but-3-enoate
CID 117268934
1,5-bis(2-methylphenyl)pentan-3-one
CID 15191871

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylphenyl)-N-oxoacetamide?
The IUPAC name of 2-(2-methylphenyl)-N-oxoacetamide (CID 89001397) is 2-(2-methylphenyl)-N-oxoacetamide.
What is the SMILES notation for 2-(2-methylphenyl)-N-oxoacetamide?
The canonical SMILES for 2-(2-methylphenyl)-N-oxoacetamide is Cc1ccccc1CC(=O)N=O.
What is the InChIKey of 2-(2-methylphenyl)-N-oxoacetamide?
The InChIKey is BNCSLQNXWOMJLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9NO2/c1-7-4-2-3-5-8(7)6-9(11)10-12/h2-5H,6H2,1H3.
What are the key properties of 2-(2-methylphenyl)-N-oxoacetamide?
2-(2-methylphenyl)-N-oxoacetamide has a molecular weight of 163.18 g/mol, XLogP of 1.83, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylphenyl)-N-oxoacetamide is sourced from PubChem (CID 89001397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).