2-methyl-N-[[4-(1-phenylpropoxy)phenyl]carbamoyl]benzamide

C24H24N2O3 — CID 20524502

IUPAC2-methyl-N-[[4-(1-phenylpropoxy)phenyl]carbamoyl]benzamide
SMILESCCC(Oc1ccc(NC(=O)NC(=O)c2ccccc2C)cc1)c1ccccc1
InChIInChI=1S/C24H24N2O3/c1-3-22(18-10-5-4-6-11-18)29-20-15-13-19(14-16-20)25-24(28)26-23(27)21-12-8-7-9-17(21)2/h4-16,22H,3H2,1-2H3,(H2,25,26,27,28)
InChIKeyZYSXFYJWYVWGKO-UHFFFAOYSA-N
MW388.47 g/mol
LogP5.49
Rot. Bonds6

About 2-methyl-N-[[4-(1-phenylpropoxy)phenyl]carbamoyl]benzamide

2-methyl-N-[[4-(1-phenylpropoxy)phenyl]carbamoyl]benzamide (PubChem CID 20524502) has the molecular formula C24H24N2O3 and a molecular weight of 388.47 g/mol. Its IUPAC name is 2-methyl-N-[[4-(1-phenylpropoxy)phenyl]carbamoyl]benzamide.

Molecular Properties

Compound Name2-methyl-N-[[4-(1-phenylpropoxy)phenyl]carbamoyl]benzamide
PubChem CID20524502
Molecular FormulaC24H24N2O3
Molecular Weight388.47 g/mol
Exact Mass388.18
IUPAC Name2-methyl-N-[[4-(1-phenylpropoxy)phenyl]carbamoyl]benzamide
SMILESCCC(Oc1ccc(NC(=O)NC(=O)c2ccccc2C)cc1)c1ccccc1
InChIInChI=1S/C24H24N2O3/c1-3-22(18-10-5-4-6-11-18)29-20-15-13-19(14-16-20)25-24(28)26-23(27)21-12-8-7-9-17(21)2/h4-16,22H,3H2,1-2H3,(H2,25,26,27,28)
InChIKeyZYSXFYJWYVWGKO-UHFFFAOYSA-N
XLogP5.49
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500388.47
LogP ≤ 55.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[4-[cyano(phenyl)methoxy]phenyl]carbamoyl]-2-methylbenzamide
CID 20524365
2-methyl-N-[[4-(1-phenoxyethyl)phenyl]carbamoyl]benzamide
CID 70577786
N-[[4-[1-(4-chlorophenoxy)ethyl]phenyl]carbamoyl]-2-methylbenzamide
CID 70575711
2-chloro-N-[[4-[1-[4-(trifluoromethyl)phenyl]pentoxy]phenyl]carbamoyl]benzamide
CID 20524440
N-[4-[(4-butan-2-yloxybenzoyl)carbamothioylamino]phenyl]-2-methylbenzamide
CID 17251830
N-[[4-(2,2-dichlorocyclopropyl)oxyphenyl]carbamoyl]-2-methylbenzamide
CID 13041497
N-(4-ethoxyphenyl)-2-methylbenzamide
CID 710558
N-[(4-ethoxyphenyl)carbamoyl]benzamide
CID 2986057
2-methyl-N-[[4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]carbamoyl]benzamide
CID 12878239
N-[4-(2-hydroxyethoxy)phenyl]-2-methylbenzamide
CID 111116241
N-[2-[(4-ethoxyphenyl)carbamoyl]phenyl]-2-methylbenzamide
CID 4941456
ethyl N-(2-methylbenzoyl)-N'-[(1S)-1-phenylethyl]carbamimidate
CID 7338518

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[4-(1-phenylpropoxy)phenyl]carbamoyl]benzamide?
The IUPAC name of 2-methyl-N-[[4-(1-phenylpropoxy)phenyl]carbamoyl]benzamide (CID 20524502) is 2-methyl-N-[[4-(1-phenylpropoxy)phenyl]carbamoyl]benzamide.
What is the SMILES notation for 2-methyl-N-[[4-(1-phenylpropoxy)phenyl]carbamoyl]benzamide?
The canonical SMILES for 2-methyl-N-[[4-(1-phenylpropoxy)phenyl]carbamoyl]benzamide is CCC(Oc1ccc(NC(=O)NC(=O)c2ccccc2C)cc1)c1ccccc1.
What is the InChIKey of 2-methyl-N-[[4-(1-phenylpropoxy)phenyl]carbamoyl]benzamide?
The InChIKey is ZYSXFYJWYVWGKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O3/c1-3-22(18-10-5-4-6-11-18)29-20-15-13-19(14-16-20)25-24(28)26-23(27)21-12-8-7-9-17(21)2/h4-16,22H,3H2,1-2H3,(H2,25,26,27,28).
What are the key properties of 2-methyl-N-[[4-(1-phenylpropoxy)phenyl]carbamoyl]benzamide?
2-methyl-N-[[4-(1-phenylpropoxy)phenyl]carbamoyl]benzamide has a molecular weight of 388.47 g/mol, XLogP of 5.49, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[4-(1-phenylpropoxy)phenyl]carbamoyl]benzamide is sourced from PubChem (CID 20524502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).