N-(2-methylphenyl)-N-[(2-methylphenyl)carbamoyl]acetamide

C17H18N2O2 — CID 4278277

IUPACN-(2-methylphenyl)-N-[(2-methylphenyl)carbamoyl]acetamide
SMILESCC(=O)N(C(=O)Nc1ccccc1C)c1ccccc1C
InChIInChI=1S/C17H18N2O2/c1-12-8-4-6-10-15(12)18-17(21)19(14(3)20)16-11-7-5-9-13(16)2/h4-11H,1-3H3,(H,18,21)
InChIKeyQXBFWWUPJXTBAG-UHFFFAOYSA-N
MW282.34 g/mol
LogP3.89
Rot. Bonds2

About N-(2-methylphenyl)-N-[(2-methylphenyl)carbamoyl]acetamide

N-(2-methylphenyl)-N-[(2-methylphenyl)carbamoyl]acetamide (PubChem CID 4278277) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is N-(2-methylphenyl)-N-[(2-methylphenyl)carbamoyl]acetamide.

Molecular Properties

Compound NameN-(2-methylphenyl)-N-[(2-methylphenyl)carbamoyl]acetamide
PubChem CID4278277
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC NameN-(2-methylphenyl)-N-[(2-methylphenyl)carbamoyl]acetamide
SMILESCC(=O)N(C(=O)Nc1ccccc1C)c1ccccc1C
InChIInChI=1S/C17H18N2O2/c1-12-8-4-6-10-15(12)18-17(21)19(14(3)20)16-11-7-5-9-13(16)2/h4-11H,1-3H3,(H,18,21)
InChIKeyQXBFWWUPJXTBAG-UHFFFAOYSA-N
XLogP3.89
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(N-acetyl-2-methylanilino)-N-(2-methylphenyl)propanamide
CID 113123619
N-(2-methylphenyl)-2-oxopropanamide
CID 82125210
1-cyano-1-methyl-3-(2-methylphenyl)urea
CID 14143275
2-(N-acetyl-2-ethylanilino)-N-(2-methylphenyl)acetamide
CID 113169101
N-[(2-methylphenyl)carbamothioyl]acetamide
CID 2791906
(2-methylphenyl)urea;phosphane
CID 175888509
2-(N-acetyl-2-bromoanilino)-N-(2-methylphenyl)acetamide
CID 113177819
N-(2-methylphenyl)-3-oxobutanamide
CID 7154
N-[(2,6-dimethylphenyl)carbamoyl]-N-phenylacetamide
CID 24854469
2-[acetyl(tert-butyl)amino]-N-(2-methylphenyl)acetamide
CID 113166145
2-(N-acetyl-2,6-dimethylanilino)-N-(2-methylphenyl)acetamide
CID 113168713
2-[(2-methylphenyl)carbamoyl-propan-2-ylamino]acetic acid
CID 61194418

Frequently Asked Questions

What is the IUPAC name of N-(2-methylphenyl)-N-[(2-methylphenyl)carbamoyl]acetamide?
The IUPAC name of N-(2-methylphenyl)-N-[(2-methylphenyl)carbamoyl]acetamide (CID 4278277) is N-(2-methylphenyl)-N-[(2-methylphenyl)carbamoyl]acetamide.
What is the SMILES notation for N-(2-methylphenyl)-N-[(2-methylphenyl)carbamoyl]acetamide?
The canonical SMILES for N-(2-methylphenyl)-N-[(2-methylphenyl)carbamoyl]acetamide is CC(=O)N(C(=O)Nc1ccccc1C)c1ccccc1C.
What is the InChIKey of N-(2-methylphenyl)-N-[(2-methylphenyl)carbamoyl]acetamide?
The InChIKey is QXBFWWUPJXTBAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O2/c1-12-8-4-6-10-15(12)18-17(21)19(14(3)20)16-11-7-5-9-13(16)2/h4-11H,1-3H3,(H,18,21).
What are the key properties of N-(2-methylphenyl)-N-[(2-methylphenyl)carbamoyl]acetamide?
N-(2-methylphenyl)-N-[(2-methylphenyl)carbamoyl]acetamide has a molecular weight of 282.34 g/mol, XLogP of 3.89, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylphenyl)-N-[(2-methylphenyl)carbamoyl]acetamide is sourced from PubChem (CID 4278277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).