3-hydroxy-N-[2-(2-hydroxyethyl)pentyl]-4-methoxybenzamide

C15H23NO4 — CID 103729015

IUPAC3-hydroxy-N-[2-(2-hydroxyethyl)pentyl]-4-methoxybenzamide
SMILESCCCC(CCO)CNC(=O)c1ccc(OC)c(O)c1
InChIInChI=1S/C15H23NO4/c1-3-4-11(7-8-17)10-16-15(19)12-5-6-14(20-2)13(18)9-12/h5-6,9,11,17-18H,3-4,7-8,10H2,1-2H3,(H,16,19)
InChIKeyFVWWBKHSEWCBBQ-UHFFFAOYSA-N
MW281.35 g/mol
LogP1.93
Rot. Bonds8

About 3-hydroxy-N-[2-(2-hydroxyethyl)pentyl]-4-methoxybenzamide

3-hydroxy-N-[2-(2-hydroxyethyl)pentyl]-4-methoxybenzamide (PubChem CID 103729015) has the molecular formula C15H23NO4 and a molecular weight of 281.35 g/mol. Its IUPAC name is 3-hydroxy-N-[2-(2-hydroxyethyl)pentyl]-4-methoxybenzamide.

Molecular Properties

Compound Name3-hydroxy-N-[2-(2-hydroxyethyl)pentyl]-4-methoxybenzamide
PubChem CID103729015
Molecular FormulaC15H23NO4
Molecular Weight281.35 g/mol
Exact Mass281.16
IUPAC Name3-hydroxy-N-[2-(2-hydroxyethyl)pentyl]-4-methoxybenzamide
SMILESCCCC(CCO)CNC(=O)c1ccc(OC)c(O)c1
InChIInChI=1S/C15H23NO4/c1-3-4-11(7-8-17)10-16-15(19)12-5-6-14(20-2)13(18)9-12/h5-6,9,11,17-18H,3-4,7-8,10H2,1-2H3,(H,16,19)
InChIKeyFVWWBKHSEWCBBQ-UHFFFAOYSA-N
XLogP1.93
TPSA78.79 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.35
LogP ≤ 51.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,2-dimethoxyethyl)-3-hydroxy-4-methoxybenzamide
CID 79726174
5-amino-N-[2-(2-hydroxyethyl)pentyl]-2-methoxybenzamide
CID 106113235
5-chloro-N-[2-(2-hydroxyethyl)pentyl]-2-methoxybenzamide
CID 103722628
N-ethyl-3-hydroxy-4-methoxybenzamide
CID 79600193
N-(2,2-diethoxyethyl)-3-hydroxy-4-methoxybenzamide
CID 79726717
N-(2-amino-3-ethylpentyl)-3-hydroxy-4-methoxybenzamide
CID 106285822
N-(2-chloro-4-methylpentyl)-3-hydroxy-4-methoxybenzamide
CID 107157421
4-chloro-N-[2-(2-hydroxyethyl)pentyl]-2-methoxybenzamide
CID 103722901
N-hexan-3-yl-3-hydroxy-4-methoxybenzamide
CID 79672456
N-[2-(2-hydroxyethyl)pentyl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 103722801
3-hydroxy-4-methoxy-N-(3-methylbutyl)benzamide
CID 79600016
N-[2-(2-chloroethyl)pentyl]-4-fluoro-3-methoxybenzamide
CID 106117497

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-[2-(2-hydroxyethyl)pentyl]-4-methoxybenzamide?
The IUPAC name of 3-hydroxy-N-[2-(2-hydroxyethyl)pentyl]-4-methoxybenzamide (CID 103729015) is 3-hydroxy-N-[2-(2-hydroxyethyl)pentyl]-4-methoxybenzamide.
What is the SMILES notation for 3-hydroxy-N-[2-(2-hydroxyethyl)pentyl]-4-methoxybenzamide?
The canonical SMILES for 3-hydroxy-N-[2-(2-hydroxyethyl)pentyl]-4-methoxybenzamide is CCCC(CCO)CNC(=O)c1ccc(OC)c(O)c1.
What is the InChIKey of 3-hydroxy-N-[2-(2-hydroxyethyl)pentyl]-4-methoxybenzamide?
The InChIKey is FVWWBKHSEWCBBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO4/c1-3-4-11(7-8-17)10-16-15(19)12-5-6-14(20-2)13(18)9-12/h5-6,9,11,17-18H,3-4,7-8,10H2,1-2H3,(H,16,19).
What are the key properties of 3-hydroxy-N-[2-(2-hydroxyethyl)pentyl]-4-methoxybenzamide?
3-hydroxy-N-[2-(2-hydroxyethyl)pentyl]-4-methoxybenzamide has a molecular weight of 281.35 g/mol, XLogP of 1.93, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-[2-(2-hydroxyethyl)pentyl]-4-methoxybenzamide is sourced from PubChem (CID 103729015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).