4-ethyl-N-[[2-(hydroxymethyl)phenyl]methyl]benzamide

C17H19NO2 — CID 110902443

IUPAC4-ethyl-N-[[2-(hydroxymethyl)phenyl]methyl]benzamide
SMILESCCc1ccc(C(=O)NCc2ccccc2CO)cc1
InChIInChI=1S/C17H19NO2/c1-2-13-7-9-14(10-8-13)17(20)18-11-15-5-3-4-6-16(15)12-19/h3-10,19H,2,11-12H2,1H3,(H,18,20)
InChIKeySJWXLLMQOCVEIT-UHFFFAOYSA-N
MW269.34 g/mol
LogP2.67
Rot. Bonds5

About 4-ethyl-N-[[2-(hydroxymethyl)phenyl]methyl]benzamide

4-ethyl-N-[[2-(hydroxymethyl)phenyl]methyl]benzamide (PubChem CID 110902443) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is 4-ethyl-N-[[2-(hydroxymethyl)phenyl]methyl]benzamide.

Molecular Properties

Compound Name4-ethyl-N-[[2-(hydroxymethyl)phenyl]methyl]benzamide
PubChem CID110902443
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC Name4-ethyl-N-[[2-(hydroxymethyl)phenyl]methyl]benzamide
SMILESCCc1ccc(C(=O)NCc2ccccc2CO)cc1
InChIInChI=1S/C17H19NO2/c1-2-13-7-9-14(10-8-13)17(20)18-11-15-5-3-4-6-16(15)12-19/h3-10,19H,2,11-12H2,1H3,(H,18,20)
InChIKeySJWXLLMQOCVEIT-UHFFFAOYSA-N
XLogP2.67
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-ethyl-N-[[2-(hydroxymethyl)phenyl]methyl]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

4-ethyl-N-[(2-hydroxyphenyl)methyl]benzamide
CID 115598851
N-[[2-(aminomethyl)phenyl]methyl]-4-ethylbenzamide
CID 62950627
4-acetyl-N-[[2-(hydroxymethyl)phenyl]methyl]benzamide
CID 111115313
4-N,4-N-diethyl-1-N-[[2-(hydroxymethyl)phenyl]methyl]benzene-1,4-dicarboxamide
CID 111102347
4-N-(4-ethylphenyl)-1-N-[(2-methylphenyl)methyl]benzene-1,4-dicarboxamide
CID 109046822
N-[[2-(hydroxymethyl)phenyl]methyl]-4-[methyl(propyl)amino]benzamide
CID 110909622
1-N-benzyl-4-N-(4-ethylphenyl)benzene-1,4-dicarboxamide
CID 109046714
N-[(4-bromophenyl)methyl]-4-ethylbenzamide
CID 61400403
N-[[4-(aminomethyl)phenyl]methyl]-4-ethylbenzamide
CID 60918762
N-benzyl-4-(hydroxymethyl)benzamide
CID 4125778
N-(2-benzamidoethyl)-4-ethylbenzamide
CID 84532761
3-N-[[2-(hydroxymethyl)phenyl]methyl]-1-N-propylbenzene-1,3-dicarboxamide
CID 111458178

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[[2-(hydroxymethyl)phenyl]methyl]benzamide?
The IUPAC name of 4-ethyl-N-[[2-(hydroxymethyl)phenyl]methyl]benzamide (CID 110902443) is 4-ethyl-N-[[2-(hydroxymethyl)phenyl]methyl]benzamide.
What is the SMILES notation for 4-ethyl-N-[[2-(hydroxymethyl)phenyl]methyl]benzamide?
The canonical SMILES for 4-ethyl-N-[[2-(hydroxymethyl)phenyl]methyl]benzamide is CCc1ccc(C(=O)NCc2ccccc2CO)cc1.
What is the InChIKey of 4-ethyl-N-[[2-(hydroxymethyl)phenyl]methyl]benzamide?
The InChIKey is SJWXLLMQOCVEIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2/c1-2-13-7-9-14(10-8-13)17(20)18-11-15-5-3-4-6-16(15)12-19/h3-10,19H,2,11-12H2,1H3,(H,18,20).
What are the key properties of 4-ethyl-N-[[2-(hydroxymethyl)phenyl]methyl]benzamide?
4-ethyl-N-[[2-(hydroxymethyl)phenyl]methyl]benzamide has a molecular weight of 269.34 g/mol, XLogP of 2.67, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[[2-(hydroxymethyl)phenyl]methyl]benzamide is sourced from PubChem (CID 110902443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).