N-(2-hydroxypentyl)-2,6-dimethoxybenzamide

C14H21NO4 — CID 115744628

IUPACN-(2-hydroxypentyl)-2,6-dimethoxybenzamide
SMILESCCCC(O)CNC(=O)c1c(OC)cccc1OC
InChIInChI=1S/C14H21NO4/c1-4-6-10(16)9-15-14(17)13-11(18-2)7-5-8-12(13)19-3/h5,7-8,10,16H,4,6,9H2,1-3H3,(H,15,17)
InChIKeyUZWSJEQZJKPYRX-UHFFFAOYSA-N
MW267.32 g/mol
LogP1.59
Rot. Bonds7

About N-(2-hydroxypentyl)-2,6-dimethoxybenzamide

N-(2-hydroxypentyl)-2,6-dimethoxybenzamide (PubChem CID 115744628) has the molecular formula C14H21NO4 and a molecular weight of 267.32 g/mol. Its IUPAC name is N-(2-hydroxypentyl)-2,6-dimethoxybenzamide.

Molecular Properties

Compound NameN-(2-hydroxypentyl)-2,6-dimethoxybenzamide
PubChem CID115744628
Molecular FormulaC14H21NO4
Molecular Weight267.32 g/mol
Exact Mass267.15
IUPAC NameN-(2-hydroxypentyl)-2,6-dimethoxybenzamide
SMILESCCCC(O)CNC(=O)c1c(OC)cccc1OC
InChIInChI=1S/C14H21NO4/c1-4-6-10(16)9-15-14(17)13-11(18-2)7-5-8-12(13)19-3/h5,7-8,10,16H,4,6,9H2,1-3H3,(H,15,17)
InChIKeyUZWSJEQZJKPYRX-UHFFFAOYSA-N
XLogP1.59
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.32
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-hydroxy-4-methylpentyl)-2,6-dimethoxybenzamide
CID 103819903
N-(2-hydroxypropyl)-2,6-dimethoxybenzamide
CID 43501194
N-(2-hydroxypentyl)-2-(2-methoxyphenoxy)acetamide
CID 115700511
2-amino-N-(2,3-dihydroxypropyl)-6-methoxybenzamide
CID 81420269
4-bromo-N-(2-hydroxypentyl)-3,5-dimethoxybenzamide
CID 115700732
N-(2-bromopentyl)-2-fluoro-6-methoxybenzamide
CID 113496506
N-(3-bromo-2-methylpropyl)-2,6-dimethoxybenzamide
CID 113275338
N-(2-hydroxy-2-thiophen-2-ylethyl)-2,6-dimethoxybenzamide
CID 90500029
2-hydroxy-N-(2-hydroxypentyl)-3-methylbenzamide
CID 113268457
N-(2-hydroxypentyl)-2-methoxy-5-nitrobenzamide
CID 115700529
N-(2,2-dimethoxyethyl)-2-hydroxy-6-methoxybenzamide
CID 84579085
N-(1-cyanobutyl)-2,6-dimethoxybenzamide
CID 61120301

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxypentyl)-2,6-dimethoxybenzamide?
The IUPAC name of N-(2-hydroxypentyl)-2,6-dimethoxybenzamide (CID 115744628) is N-(2-hydroxypentyl)-2,6-dimethoxybenzamide.
What is the SMILES notation for N-(2-hydroxypentyl)-2,6-dimethoxybenzamide?
The canonical SMILES for N-(2-hydroxypentyl)-2,6-dimethoxybenzamide is CCCC(O)CNC(=O)c1c(OC)cccc1OC.
What is the InChIKey of N-(2-hydroxypentyl)-2,6-dimethoxybenzamide?
The InChIKey is UZWSJEQZJKPYRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO4/c1-4-6-10(16)9-15-14(17)13-11(18-2)7-5-8-12(13)19-3/h5,7-8,10,16H,4,6,9H2,1-3H3,(H,15,17).
What are the key properties of N-(2-hydroxypentyl)-2,6-dimethoxybenzamide?
N-(2-hydroxypentyl)-2,6-dimethoxybenzamide has a molecular weight of 267.32 g/mol, XLogP of 1.59, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxypentyl)-2,6-dimethoxybenzamide is sourced from PubChem (CID 115744628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).