4-[[2-[(4-methoxyphenyl)methylamino]acetyl]amino]-N-propylbenzamide

C20H25N3O3 — CID 54837977

IUPAC4-[[2-[(4-methoxyphenyl)methylamino]acetyl]amino]-N-propylbenzamide
SMILESCCCNC(=O)c1ccc(NC(=O)CNCc2ccc(OC)cc2)cc1
InChIInChI=1S/C20H25N3O3/c1-3-12-22-20(25)16-6-8-17(9-7-16)23-19(24)14-21-13-15-4-10-18(26-2)11-5-15/h4-11,21H,3,12-14H2,1-2H3,(H,22,25)(H,23,24)
InChIKeyKVBYASIZNHMEIJ-UHFFFAOYSA-N
MW355.44 g/mol
LogP2.56
Rot. Bonds9

About 4-[[2-[(4-methoxyphenyl)methylamino]acetyl]amino]-N-propylbenzamide

4-[[2-[(4-methoxyphenyl)methylamino]acetyl]amino]-N-propylbenzamide (PubChem CID 54837977) has the molecular formula C20H25N3O3 and a molecular weight of 355.44 g/mol. Its IUPAC name is 4-[[2-[(4-methoxyphenyl)methylamino]acetyl]amino]-N-propylbenzamide.

Molecular Properties

Compound Name4-[[2-[(4-methoxyphenyl)methylamino]acetyl]amino]-N-propylbenzamide
PubChem CID54837977
Molecular FormulaC20H25N3O3
Molecular Weight355.44 g/mol
Exact Mass355.19
IUPAC Name4-[[2-[(4-methoxyphenyl)methylamino]acetyl]amino]-N-propylbenzamide
SMILESCCCNC(=O)c1ccc(NC(=O)CNCc2ccc(OC)cc2)cc1
InChIInChI=1S/C20H25N3O3/c1-3-12-22-20(25)16-6-8-17(9-7-16)23-19(24)14-21-13-15-4-10-18(26-2)11-5-15/h4-11,21H,3,12-14H2,1-2H3,(H,22,25)(H,23,24)
InChIKeyKVBYASIZNHMEIJ-UHFFFAOYSA-N
XLogP2.56
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 52.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 4-[[2-[(4-methoxyphenyl)methylamino]acetyl]amino]-N-propylbenzamide 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

4-[[2-[(4-methoxyphenyl)methylamino]acetyl]amino]-N-propan-2-ylbenzamide
CID 54837767
N-(4-methoxyphenyl)-2-[(4-methylphenyl)methylamino]acetamide
CID 19164026
N-(4-acetamidophenyl)-2-[(4-methoxyphenyl)methylamino]acetamide
CID 54838346
N-(3-methoxypropyl)-4-[[2-[(4-propan-2-yloxyphenyl)methylamino]acetyl]amino]benzamide
CID 54845211
N-[2-(4-methoxyanilino)-2-oxoethyl]-4-pentylbenzamide
CID 4016608
2-[(4-fluorophenyl)methylamino]-N-[2-(4-methoxyanilino)-2-oxoethyl]acetamide
CID 24718593
4-N-[2-(4-methoxyphenyl)ethyl]-1-N-propylbenzene-1,4-dicarboxamide
CID 109042916
4-[(4-methoxybenzoyl)carbamothioylamino]-N-propylbenzamide
CID 17219121
3-[[2-[(4-methoxyphenyl)methylamino]acetyl]amino]-N-(3-methoxypropyl)benzamide
CID 54837826
N-ethyl-4-[[2-(propylamino)acetyl]amino]benzamide
CID 54818586
N-[2-(4-methoxyanilino)-2-oxoethyl]-2-(4-methoxyphenyl)acetamide
CID 112998708
4-[[2-[4-(benzylcarbamoyl)anilino]-2-oxoethyl]amino]-N-propylbenzamide
CID 54835804

Frequently Asked Questions

What is the IUPAC name of 4-[[2-[(4-methoxyphenyl)methylamino]acetyl]amino]-N-propylbenzamide?
The IUPAC name of 4-[[2-[(4-methoxyphenyl)methylamino]acetyl]amino]-N-propylbenzamide (CID 54837977) is 4-[[2-[(4-methoxyphenyl)methylamino]acetyl]amino]-N-propylbenzamide.
What is the SMILES notation for 4-[[2-[(4-methoxyphenyl)methylamino]acetyl]amino]-N-propylbenzamide?
The canonical SMILES for 4-[[2-[(4-methoxyphenyl)methylamino]acetyl]amino]-N-propylbenzamide is CCCNC(=O)c1ccc(NC(=O)CNCc2ccc(OC)cc2)cc1.
What is the InChIKey of 4-[[2-[(4-methoxyphenyl)methylamino]acetyl]amino]-N-propylbenzamide?
The InChIKey is KVBYASIZNHMEIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O3/c1-3-12-22-20(25)16-6-8-17(9-7-16)23-19(24)14-21-13-15-4-10-18(26-2)11-5-15/h4-11,21H,3,12-14H2,1-2H3,(H,22,25)(H,23,24).
What are the key properties of 4-[[2-[(4-methoxyphenyl)methylamino]acetyl]amino]-N-propylbenzamide?
4-[[2-[(4-methoxyphenyl)methylamino]acetyl]amino]-N-propylbenzamide has a molecular weight of 355.44 g/mol, XLogP of 2.56, 9 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-[(4-methoxyphenyl)methylamino]acetyl]amino]-N-propylbenzamide is sourced from PubChem (CID 54837977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).