4-chloro-N-[2-(2-hydroxyethyl)pentyl]-2-methoxybenzamide

C15H22ClNO3 — CID 103722901

IUPAC4-chloro-N-[2-(2-hydroxyethyl)pentyl]-2-methoxybenzamide
SMILESCCCC(CCO)CNC(=O)c1ccc(Cl)cc1OC
InChIInChI=1S/C15H22ClNO3/c1-3-4-11(7-8-18)10-17-15(19)13-6-5-12(16)9-14(13)20-2/h5-6,9,11,18H,3-4,7-8,10H2,1-2H3,(H,17,19)
InChIKeyNFRJFWSUAYUGTE-UHFFFAOYSA-N
MW299.80 g/mol
LogP2.88
Rot. Bonds8

About 4-chloro-N-[2-(2-hydroxyethyl)pentyl]-2-methoxybenzamide

4-chloro-N-[2-(2-hydroxyethyl)pentyl]-2-methoxybenzamide (PubChem CID 103722901) has the molecular formula C15H22ClNO3 and a molecular weight of 299.80 g/mol. Its IUPAC name is 4-chloro-N-[2-(2-hydroxyethyl)pentyl]-2-methoxybenzamide.

Molecular Properties

Compound Name4-chloro-N-[2-(2-hydroxyethyl)pentyl]-2-methoxybenzamide
PubChem CID103722901
Molecular FormulaC15H22ClNO3
Molecular Weight299.80 g/mol
Exact Mass299.13
IUPAC Name4-chloro-N-[2-(2-hydroxyethyl)pentyl]-2-methoxybenzamide
SMILESCCCC(CCO)CNC(=O)c1ccc(Cl)cc1OC
InChIInChI=1S/C15H22ClNO3/c1-3-4-11(7-8-18)10-17-15(19)13-6-5-12(16)9-14(13)20-2/h5-6,9,11,18H,3-4,7-8,10H2,1-2H3,(H,17,19)
InChIKeyNFRJFWSUAYUGTE-UHFFFAOYSA-N
XLogP2.88
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.80
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-chloro-N-[2-(2-hydroxyethyl)pentyl]-2-methoxybenzamide 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

5-chloro-N-[2-(2-hydroxyethyl)pentyl]-2-methoxybenzamide
CID 103722628
2,5-dichloro-N-[2-(2-hydroxyethyl)pentyl]benzamide
CID 103725481
5-amino-N-[2-(2-hydroxyethyl)pentyl]-2-methoxybenzamide
CID 106113235
2-chloro-N-[2-(2-hydroxyethyl)pentyl]-4-methylbenzamide
CID 106509848
4-chloro-N-(2-chloro-3-methylbutyl)-2-methoxybenzamide
CID 113492957
2-chloro-N-[2-(2-hydroxyethyl)pentyl]benzamide
CID 103722702
3-hydroxy-N-[2-(2-hydroxyethyl)pentyl]-4-methoxybenzamide
CID 103729015
5-chloro-N-(4-hydroxy-2-methylbutyl)-2-methoxybenzamide
CID 66109284
N-[2-(2-hydroxyethyl)pentyl]-2,5-dimethylbenzamide
CID 103725617
N-[2-(2-hydroxyethyl)pentyl]-2,4-dimethylbenzamide
CID 103722758
4-chloro-N-(2-cyclopropyl-2-hydroxyethyl)-2-methoxybenzamide
CID 63298974
5-chloro-N-(2-ethyl-4-hydroxybutyl)-2-iodobenzamide
CID 113254459

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[2-(2-hydroxyethyl)pentyl]-2-methoxybenzamide?
The IUPAC name of 4-chloro-N-[2-(2-hydroxyethyl)pentyl]-2-methoxybenzamide (CID 103722901) is 4-chloro-N-[2-(2-hydroxyethyl)pentyl]-2-methoxybenzamide.
What is the SMILES notation for 4-chloro-N-[2-(2-hydroxyethyl)pentyl]-2-methoxybenzamide?
The canonical SMILES for 4-chloro-N-[2-(2-hydroxyethyl)pentyl]-2-methoxybenzamide is CCCC(CCO)CNC(=O)c1ccc(Cl)cc1OC.
What is the InChIKey of 4-chloro-N-[2-(2-hydroxyethyl)pentyl]-2-methoxybenzamide?
The InChIKey is NFRJFWSUAYUGTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClNO3/c1-3-4-11(7-8-18)10-17-15(19)13-6-5-12(16)9-14(13)20-2/h5-6,9,11,18H,3-4,7-8,10H2,1-2H3,(H,17,19).
What are the key properties of 4-chloro-N-[2-(2-hydroxyethyl)pentyl]-2-methoxybenzamide?
4-chloro-N-[2-(2-hydroxyethyl)pentyl]-2-methoxybenzamide has a molecular weight of 299.80 g/mol, XLogP of 2.88, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[2-(2-hydroxyethyl)pentyl]-2-methoxybenzamide is sourced from PubChem (CID 103722901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).