4-(acetamidomethyl)-N-benzyl-N-(2-hydroxyethyl)benzamide

C19H22N2O3 — CID 110880403

IUPAC4-(acetamidomethyl)-N-benzyl-N-(2-hydroxyethyl)benzamide
SMILESCC(=O)NCc1ccc(C(=O)N(CCO)Cc2ccccc2)cc1
InChIInChI=1S/C19H22N2O3/c1-15(23)20-13-16-7-9-18(10-8-16)19(24)21(11-12-22)14-17-5-3-2-4-6-17/h2-10,22H,11-14H2,1H3,(H,20,23)
InChIKeyGVUPFVZWYMHDCR-UHFFFAOYSA-N
MW326.40 g/mol
LogP1.96
Rot. Bonds7

About 4-(acetamidomethyl)-N-benzyl-N-(2-hydroxyethyl)benzamide

4-(acetamidomethyl)-N-benzyl-N-(2-hydroxyethyl)benzamide (PubChem CID 110880403) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is 4-(acetamidomethyl)-N-benzyl-N-(2-hydroxyethyl)benzamide.

Molecular Properties

Compound Name4-(acetamidomethyl)-N-benzyl-N-(2-hydroxyethyl)benzamide
PubChem CID110880403
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC Name4-(acetamidomethyl)-N-benzyl-N-(2-hydroxyethyl)benzamide
SMILESCC(=O)NCc1ccc(C(=O)N(CCO)Cc2ccccc2)cc1
InChIInChI=1S/C19H22N2O3/c1-15(23)20-13-16-7-9-18(10-8-16)19(24)21(11-12-22)14-17-5-3-2-4-6-17/h2-10,22H,11-14H2,1H3,(H,20,23)
InChIKeyGVUPFVZWYMHDCR-UHFFFAOYSA-N
XLogP1.96
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-(acetamidomethyl)-N-benzyl-N-(2-hydroxyethyl)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

2-[[4-(acetamidomethyl)benzoyl]-(2-phenylethyl)amino]acetic acid
CID 119347576
1-benzyl-1-(2-hydroxyethyl)-3-[(4-methylphenyl)methyl]urea
CID 108899087
N'-benzyl-N'-(2-hydroxyethyl)-N-[(4-methylphenyl)methyl]oxamide
CID 108518112
1-N,3-N-dibenzyl-1-N,3-N-bis(2-hydroxyethyl)benzene-1,3-dicarboxamide
CID 3309530
N-benzyl-3,4-dihydroxy-N-(2-hydroxyethyl)benzamide
CID 103955560
N-benzyl-4-[(carbamoylamino)methyl]-N-(2-methoxyethyl)benzamide
CID 17419919
N'-benzyl-N,N,N'-tris(2-hydroxyethyl)oxamide
CID 108509868
N-benzyl-2-[(4-fluorophenyl)methylcarbamoylamino]-N-(2-hydroxyethyl)acetamide
CID 78855212
N-benzyl-N-(2-hydroxyethyl)-2-(methylamino)acetamide
CID 58786294
1-N-(2-aminophenyl)-4-N-benzyl-4-N-(2-hydroxyethyl)benzene-1,4-dicarboxamide
CID 25052283
N'-benzyl-N-ethyl-N'-(2-hydroxyethyl)oxamide
CID 108521418
4-(acetamidomethyl)-N-[[4-(diethylcarbamoyl)phenyl]methyl]benzamide
CID 39020952

Frequently Asked Questions

What is the IUPAC name of 4-(acetamidomethyl)-N-benzyl-N-(2-hydroxyethyl)benzamide?
The IUPAC name of 4-(acetamidomethyl)-N-benzyl-N-(2-hydroxyethyl)benzamide (CID 110880403) is 4-(acetamidomethyl)-N-benzyl-N-(2-hydroxyethyl)benzamide.
What is the SMILES notation for 4-(acetamidomethyl)-N-benzyl-N-(2-hydroxyethyl)benzamide?
The canonical SMILES for 4-(acetamidomethyl)-N-benzyl-N-(2-hydroxyethyl)benzamide is CC(=O)NCc1ccc(C(=O)N(CCO)Cc2ccccc2)cc1.
What is the InChIKey of 4-(acetamidomethyl)-N-benzyl-N-(2-hydroxyethyl)benzamide?
The InChIKey is GVUPFVZWYMHDCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-15(23)20-13-16-7-9-18(10-8-16)19(24)21(11-12-22)14-17-5-3-2-4-6-17/h2-10,22H,11-14H2,1H3,(H,20,23).
What are the key properties of 4-(acetamidomethyl)-N-benzyl-N-(2-hydroxyethyl)benzamide?
4-(acetamidomethyl)-N-benzyl-N-(2-hydroxyethyl)benzamide has a molecular weight of 326.40 g/mol, XLogP of 1.96, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(acetamidomethyl)-N-benzyl-N-(2-hydroxyethyl)benzamide is sourced from PubChem (CID 110880403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).