2-[(3-methoxyphenyl)carbamoylamino]-N-(2-methylpropyl)benzamide

C19H23N3O3 — CID 100745717

IUPAC2-[(3-methoxyphenyl)carbamoylamino]-N-(2-methylpropyl)benzamide
SMILESCOc1cccc(NC(=O)Nc2ccccc2C(=O)NCC(C)C)c1
InChIInChI=1S/C19H23N3O3/c1-13(2)12-20-18(23)16-9-4-5-10-17(16)22-19(24)21-14-7-6-8-15(11-14)25-3/h4-11,13H,12H2,1-3H3,(H,20,23)(H2,21,22,24)
InChIKeyFKVYTJJARMJAPL-UHFFFAOYSA-N
MW341.41 g/mol
LogP3.72
Rot. Bonds6

About 2-[(3-methoxyphenyl)carbamoylamino]-N-(2-methylpropyl)benzamide

2-[(3-methoxyphenyl)carbamoylamino]-N-(2-methylpropyl)benzamide (PubChem CID 100745717) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is 2-[(3-methoxyphenyl)carbamoylamino]-N-(2-methylpropyl)benzamide.

Molecular Properties

Compound Name2-[(3-methoxyphenyl)carbamoylamino]-N-(2-methylpropyl)benzamide
PubChem CID100745717
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Name2-[(3-methoxyphenyl)carbamoylamino]-N-(2-methylpropyl)benzamide
SMILESCOc1cccc(NC(=O)Nc2ccccc2C(=O)NCC(C)C)c1
InChIInChI=1S/C19H23N3O3/c1-13(2)12-20-18(23)16-9-4-5-10-17(16)22-19(24)21-14-7-6-8-15(11-14)25-3/h4-11,13H,12H2,1-3H3,(H,20,23)(H2,21,22,24)
InChIKeyFKVYTJJARMJAPL-UHFFFAOYSA-N
XLogP3.72
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 53.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(3-methoxyphenoxy)butanoylamino]-N-(2-methylpropyl)benzamide
CID 43909267
1-(3-methoxyphenyl)-3-(2-propan-2-ylphenyl)urea
CID 99129467
2-(3-methoxyanilino)-N-[2-(methylamino)propyl]benzamide;dihydrochloride
CID 120826494
2-(dimethylamino)-5-[(2-methoxyphenyl)carbamoylamino]-N-(2-methylpropyl)benzamide
CID 42747759
N-(3,4-dimethoxyphenyl)-2-(2-methylpropylcarbamoylamino)benzamide
CID 110609641
1-[2-(1-aminoethyl)phenyl]-3-(3-methoxyphenyl)urea
CID 61310773
2-[(3-methoxybenzoyl)amino]-N-(3-methoxyphenyl)benzamide
CID 51154923
N-[2-[(3-methoxyphenyl)carbamoyl]phenyl]-2-methylbenzamide
CID 51154926
1-(3-methoxyphenyl)-3-[2-(piperidine-1-carbonyl)phenyl]urea
CID 99129473
5-[(2,4-dimethoxyphenyl)carbamoylamino]-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(2-methylpropyl)benzamide
CID 42752990
1-(3-methoxyphenyl)-3-(2-phenylpropyl)urea
CID 51328278
N-(2-methylpropyl)-2-[(2-phenoxyacetyl)amino]benzamide
CID 18089922

Frequently Asked Questions

What is the IUPAC name of 2-[(3-methoxyphenyl)carbamoylamino]-N-(2-methylpropyl)benzamide?
The IUPAC name of 2-[(3-methoxyphenyl)carbamoylamino]-N-(2-methylpropyl)benzamide (CID 100745717) is 2-[(3-methoxyphenyl)carbamoylamino]-N-(2-methylpropyl)benzamide.
What is the SMILES notation for 2-[(3-methoxyphenyl)carbamoylamino]-N-(2-methylpropyl)benzamide?
The canonical SMILES for 2-[(3-methoxyphenyl)carbamoylamino]-N-(2-methylpropyl)benzamide is COc1cccc(NC(=O)Nc2ccccc2C(=O)NCC(C)C)c1.
What is the InChIKey of 2-[(3-methoxyphenyl)carbamoylamino]-N-(2-methylpropyl)benzamide?
The InChIKey is FKVYTJJARMJAPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-13(2)12-20-18(23)16-9-4-5-10-17(16)22-19(24)21-14-7-6-8-15(11-14)25-3/h4-11,13H,12H2,1-3H3,(H,20,23)(H2,21,22,24).
What are the key properties of 2-[(3-methoxyphenyl)carbamoylamino]-N-(2-methylpropyl)benzamide?
2-[(3-methoxyphenyl)carbamoylamino]-N-(2-methylpropyl)benzamide has a molecular weight of 341.41 g/mol, XLogP of 3.72, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-methoxyphenyl)carbamoylamino]-N-(2-methylpropyl)benzamide is sourced from PubChem (CID 100745717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).