N-(3-methylphenyl)-2-(naphthalen-1-ylcarbamoylamino)benzamide

C25H21N3O2 — CID 2223034

IUPACN-(3-methylphenyl)-2-(naphthalen-1-ylcarbamoylamino)benzamide
SMILESCc1cccc(NC(=O)c2ccccc2NC(=O)Nc2cccc3ccccc23)c1
InChIInChI=1S/C25H21N3O2/c1-17-8-6-11-19(16-17)26-24(29)21-13-4-5-14-23(21)28-25(30)27-22-15-7-10-18-9-2-3-12-20(18)22/h2-16H,1H3,(H,26,29)(H2,27,28,30)
InChIKeyOKDVSWSYMRTCRM-UHFFFAOYSA-N
MW395.46 g/mol
LogP6.04
Rot. Bonds4

About N-(3-methylphenyl)-2-(naphthalen-1-ylcarbamoylamino)benzamide

N-(3-methylphenyl)-2-(naphthalen-1-ylcarbamoylamino)benzamide (PubChem CID 2223034) has the molecular formula C25H21N3O2 and a molecular weight of 395.46 g/mol. Its IUPAC name is N-(3-methylphenyl)-2-(naphthalen-1-ylcarbamoylamino)benzamide.

Molecular Properties

Compound NameN-(3-methylphenyl)-2-(naphthalen-1-ylcarbamoylamino)benzamide
PubChem CID2223034
Molecular FormulaC25H21N3O2
Molecular Weight395.46 g/mol
Exact Mass395.16
IUPAC NameN-(3-methylphenyl)-2-(naphthalen-1-ylcarbamoylamino)benzamide
SMILESCc1cccc(NC(=O)c2ccccc2NC(=O)Nc2cccc3ccccc23)c1
InChIInChI=1S/C25H21N3O2/c1-17-8-6-11-19(16-17)26-24(29)21-13-4-5-14-23(21)28-25(30)27-22-15-7-10-18-9-2-3-12-20(18)22/h2-16H,1H3,(H,26,29)(H2,27,28,30)
InChIKeyOKDVSWSYMRTCRM-UHFFFAOYSA-N
XLogP6.04
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500395.46
LogP ≤ 56.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze N-(3-methylphenyl)-2-(naphthalen-1-ylcarbamoylamino)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(7-hydroxynaphthalen-1-yl)-3-(3-methylphenyl)urea
CID 54581579
2-[(2-chlorobenzoyl)amino]-N-(3-methylphenyl)benzamide
CID 29448368
N-(3-methylphenyl)-2-(propylamino)benzamide
CID 62171242
4-methyl-2-[(3-methylphenyl)carbamoylamino]-N-naphthalen-1-yl-1,3-thiazole-5-carboxamide
CID 16897211
2-[[2-[[2-(2-ethylanilino)-2-oxoethyl]-methylamino]acetyl]amino]-N-(3-methylphenyl)benzamide
CID 55411601
N-phenyl-2-[[2-(phenylcarbamoyl)phenyl]carbamoylamino]benzamide
CID 139684594
1-naphthalen-1-yl-3-[2-(naphthalen-1-ylcarbamoylamino)phenyl]urea
CID 177491059
1-naphthalen-1-yl-3-[5-(naphthalen-1-ylcarbamoylamino)naphthalen-1-yl]urea
CID 27190755
2-bromo-N-(3-methylphenyl)benzamide
CID 532187
[2-[2-[(3-methylphenyl)carbamoyl]anilino]-2-oxoethyl] 4-oxopentanoate
CID 9199226
methyl 3-[[2-[(3-methylphenyl)carbamoyl]phenyl]carbamoyl]benzoate
CID 52636365
2-[[2-(1,3-dioxoisoindol-2-yl)acetyl]amino]-N-(3-methylphenyl)benzamide
CID 8874197

Frequently Asked Questions

What is the IUPAC name of N-(3-methylphenyl)-2-(naphthalen-1-ylcarbamoylamino)benzamide?
The IUPAC name of N-(3-methylphenyl)-2-(naphthalen-1-ylcarbamoylamino)benzamide (CID 2223034) is N-(3-methylphenyl)-2-(naphthalen-1-ylcarbamoylamino)benzamide.
What is the SMILES notation for N-(3-methylphenyl)-2-(naphthalen-1-ylcarbamoylamino)benzamide?
The canonical SMILES for N-(3-methylphenyl)-2-(naphthalen-1-ylcarbamoylamino)benzamide is Cc1cccc(NC(=O)c2ccccc2NC(=O)Nc2cccc3ccccc23)c1.
What is the InChIKey of N-(3-methylphenyl)-2-(naphthalen-1-ylcarbamoylamino)benzamide?
The InChIKey is OKDVSWSYMRTCRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21N3O2/c1-17-8-6-11-19(16-17)26-24(29)21-13-4-5-14-23(21)28-25(30)27-22-15-7-10-18-9-2-3-12-20(18)22/h2-16H,1H3,(H,26,29)(H2,27,28,30).
What are the key properties of N-(3-methylphenyl)-2-(naphthalen-1-ylcarbamoylamino)benzamide?
N-(3-methylphenyl)-2-(naphthalen-1-ylcarbamoylamino)benzamide has a molecular weight of 395.46 g/mol, XLogP of 6.04, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylphenyl)-2-(naphthalen-1-ylcarbamoylamino)benzamide is sourced from PubChem (CID 2223034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).