N-hexan-3-yl-2-hydroxybenzamide

C13H19NO2 — CID 62046226

IUPACN-hexan-3-yl-2-hydroxybenzamide
SMILESCCCC(CC)NC(=O)c1ccccc1O
InChIInChI=1S/C13H19NO2/c1-3-7-10(4-2)14-13(16)11-8-5-6-9-12(11)15/h5-6,8-10,15H,3-4,7H2,1-2H3,(H,14,16)
InChIKeyYUIDPZKKKWDLNF-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.70
Rot. Bonds5

About N-hexan-3-yl-2-hydroxybenzamide

N-hexan-3-yl-2-hydroxybenzamide (PubChem CID 62046226) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is N-hexan-3-yl-2-hydroxybenzamide.

Molecular Properties

Compound NameN-hexan-3-yl-2-hydroxybenzamide
PubChem CID62046226
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC NameN-hexan-3-yl-2-hydroxybenzamide
SMILESCCCC(CC)NC(=O)c1ccccc1O
InChIInChI=1S/C13H19NO2/c1-3-7-10(4-2)14-13(16)11-8-5-6-9-12(11)15/h5-6,8-10,15H,3-4,7H2,1-2H3,(H,14,16)
InChIKeyYUIDPZKKKWDLNF-UHFFFAOYSA-N
XLogP2.70
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-hexan-3-yl-2-hydroxybenzamide 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

N-(1-chlorobutan-2-yl)-2-hydroxybenzamide
CID 114294495
2-[2-(hexan-3-ylcarbamoyl)phenyl]acetic acid
CID 114199808
N-hexan-3-yl-3-hydroxypyridine-4-carboxamide
CID 81442686
2-[(2-hydroxybenzoyl)amino]pentanoic acid
CID 43630253
3-amino-N-hexan-3-ylnaphthalene-2-carboxamide
CID 62117269
3-amino-2-chloro-N-hexan-3-ylbenzamide
CID 112575833
2-hydroxy-N-(2-methylpentan-3-yl)benzamide
CID 61465472
N-hexan-3-yl-3-hydroxybenzamide
CID 62118966
N-pentan-3-yl-2-[(2S)-pentan-2-yl]oxybenzamide
CID 164755077
2-methylsulfonyl-N-pentan-3-ylbenzamide
CID 16625808
N-hexan-3-yl-3-hydroxy-4-methylbenzamide
CID 62118967
N-hexan-3-yl-2-phenylacetamide
CID 129166933

Frequently Asked Questions

What is the IUPAC name of N-hexan-3-yl-2-hydroxybenzamide?
The IUPAC name of N-hexan-3-yl-2-hydroxybenzamide (CID 62046226) is N-hexan-3-yl-2-hydroxybenzamide.
What is the SMILES notation for N-hexan-3-yl-2-hydroxybenzamide?
The canonical SMILES for N-hexan-3-yl-2-hydroxybenzamide is CCCC(CC)NC(=O)c1ccccc1O.
What is the InChIKey of N-hexan-3-yl-2-hydroxybenzamide?
The InChIKey is YUIDPZKKKWDLNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-3-7-10(4-2)14-13(16)11-8-5-6-9-12(11)15/h5-6,8-10,15H,3-4,7H2,1-2H3,(H,14,16).
What are the key properties of N-hexan-3-yl-2-hydroxybenzamide?
N-hexan-3-yl-2-hydroxybenzamide has a molecular weight of 221.30 g/mol, XLogP of 2.70, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-hexan-3-yl-2-hydroxybenzamide is sourced from PubChem (CID 62046226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).