N-[3-(2-hydroxyethoxy)propyl]-2-phenylbenzamide

C18H21NO3 — CID 110022367

IUPACN-[3-(2-hydroxyethoxy)propyl]-2-phenylbenzamide
SMILESO=C(NCCCOCCO)c1ccccc1-c1ccccc1
InChIInChI=1S/C18H21NO3/c20-12-14-22-13-6-11-19-18(21)17-10-5-4-9-16(17)15-7-2-1-3-8-15/h1-5,7-10,20H,6,11-14H2,(H,19,21)
InChIKeyAWGLPWZRVFERRS-UHFFFAOYSA-N
MW299.37 g/mol
LogP2.48
Rot. Bonds8

About N-[3-(2-hydroxyethoxy)propyl]-2-phenylbenzamide

N-[3-(2-hydroxyethoxy)propyl]-2-phenylbenzamide (PubChem CID 110022367) has the molecular formula C18H21NO3 and a molecular weight of 299.37 g/mol. Its IUPAC name is N-[3-(2-hydroxyethoxy)propyl]-2-phenylbenzamide.

Molecular Properties

Compound NameN-[3-(2-hydroxyethoxy)propyl]-2-phenylbenzamide
PubChem CID110022367
Molecular FormulaC18H21NO3
Molecular Weight299.37 g/mol
Exact Mass299.15
IUPAC NameN-[3-(2-hydroxyethoxy)propyl]-2-phenylbenzamide
SMILESO=C(NCCCOCCO)c1ccccc1-c1ccccc1
InChIInChI=1S/C18H21NO3/c20-12-14-22-13-6-11-19-18(21)17-10-5-4-9-16(17)15-7-2-1-3-8-15/h1-5,7-10,20H,6,11-14H2,(H,19,21)
InChIKeyAWGLPWZRVFERRS-UHFFFAOYSA-N
XLogP2.48
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[3-(2-hydroxyethoxy)propyl]-2-phenylbenzamide 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-amino-N-[3-(2-hydroxyethoxy)propyl]benzamide
CID 106308242
N-butyl-2-phenylbenzamide
CID 21064565
2-amino-3-chloro-N-[3-(2-hydroxyethoxy)propyl]benzamide
CID 106308339
5-[(2-phenylbenzoyl)amino]pentyl prop-2-enoate
CID 171768588
4-(4-fluorophenyl)-N-[3-(2-hydroxyethoxy)propyl]-1H-pyrrole-3-carboxamide
CID 75451638
N-(3-methoxypropyl)-2-[4-(trifluoromethyl)phenyl]benzamide
CID 35513604
2,5-dibromo-N-[3-(2-hydroxyethoxy)propyl]benzamide
CID 104920678
N-[3-(2-bromoethoxy)propyl]-2-hydroxybenzamide
CID 106307317
N-[3-(2-methoxyethoxy)propyl]-4-phenylbenzamide
CID 134029636
N-butyl-2-hydroxy-3-phenylbenzamide
CID 8579
2-chloro-N-[2-(2-phenylphenoxy)ethyl]benzamide
CID 2994239
5-fluoro-N-[3-(2-hydroxyethoxy)propyl]-2-methylbenzamide
CID 113364744

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-hydroxyethoxy)propyl]-2-phenylbenzamide?
The IUPAC name of N-[3-(2-hydroxyethoxy)propyl]-2-phenylbenzamide (CID 110022367) is N-[3-(2-hydroxyethoxy)propyl]-2-phenylbenzamide.
What is the SMILES notation for N-[3-(2-hydroxyethoxy)propyl]-2-phenylbenzamide?
The canonical SMILES for N-[3-(2-hydroxyethoxy)propyl]-2-phenylbenzamide is O=C(NCCCOCCO)c1ccccc1-c1ccccc1.
What is the InChIKey of N-[3-(2-hydroxyethoxy)propyl]-2-phenylbenzamide?
The InChIKey is AWGLPWZRVFERRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO3/c20-12-14-22-13-6-11-19-18(21)17-10-5-4-9-16(17)15-7-2-1-3-8-15/h1-5,7-10,20H,6,11-14H2,(H,19,21).
What are the key properties of N-[3-(2-hydroxyethoxy)propyl]-2-phenylbenzamide?
N-[3-(2-hydroxyethoxy)propyl]-2-phenylbenzamide has a molecular weight of 299.37 g/mol, XLogP of 2.48, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-hydroxyethoxy)propyl]-2-phenylbenzamide is sourced from PubChem (CID 110022367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).