N-[2-(2-hydroxyethyl)pentyl]-3,5-dimethylbenzamide

C16H25NO2 — CID 103722617

IUPACN-[2-(2-hydroxyethyl)pentyl]-3,5-dimethylbenzamide
SMILESCCCC(CCO)CNC(=O)c1cc(C)cc(C)c1
InChIInChI=1S/C16H25NO2/c1-4-5-14(6-7-18)11-17-16(19)15-9-12(2)8-13(3)10-15/h8-10,14,18H,4-7,11H2,1-3H3,(H,17,19)
InChIKeyTZWHHUXNLPXSIZ-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.83
Rot. Bonds7

About N-[2-(2-hydroxyethyl)pentyl]-3,5-dimethylbenzamide

N-[2-(2-hydroxyethyl)pentyl]-3,5-dimethylbenzamide (PubChem CID 103722617) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is N-[2-(2-hydroxyethyl)pentyl]-3,5-dimethylbenzamide.

Molecular Properties

Compound NameN-[2-(2-hydroxyethyl)pentyl]-3,5-dimethylbenzamide
PubChem CID103722617
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC NameN-[2-(2-hydroxyethyl)pentyl]-3,5-dimethylbenzamide
SMILESCCCC(CCO)CNC(=O)c1cc(C)cc(C)c1
InChIInChI=1S/C16H25NO2/c1-4-5-14(6-7-18)11-17-16(19)15-9-12(2)8-13(3)10-15/h8-10,14,18H,4-7,11H2,1-3H3,(H,17,19)
InChIKeyTZWHHUXNLPXSIZ-UHFFFAOYSA-N
XLogP2.83
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[2-(2-hydroxyethyl)pentyl]-3,5-dimethylbenzamide 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-(2-ethyl-4-hydroxybutyl)-3-fluoro-5-methylbenzamide
CID 112699624
2-hydroxy-N-[2-(2-hydroxyethyl)pentyl]-3,5-dimethylbenzamide
CID 111697266
N-[2-(2-hydroxyethyl)pentyl]pyridine-4-carboxamide
CID 111662354
N-[2-(2-hydroxyethyl)pentyl]-2,5-dimethylbenzamide
CID 103725617
N-[2-(2-hydroxyethyl)pentyl]-2,4-dimethylbenzamide
CID 103722758
N-[(2R)-2-(2-hydroxyethyl)pentyl]-3-methyl-4-nitrobenzamide
CID 96525519
N-[2-(2-hydroxyethyl)pentyl]-3-iodobenzamide
CID 103722668
N-[2-(2-hydroxyethyl)pentyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 111662305
2-chloro-N-[2-(2-hydroxyethyl)pentyl]-4-methylbenzamide
CID 106509848
3-bromo-N-[2-(2-hydroxyethyl)pentyl]-5-nitrobenzamide
CID 103819803
N-[2-(2-hydroxyethyl)pentyl]-4-methylsulfonylbenzamide
CID 103722829
N-[2-(2-hydroxyethyl)pentyl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 103722801

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-hydroxyethyl)pentyl]-3,5-dimethylbenzamide?
The IUPAC name of N-[2-(2-hydroxyethyl)pentyl]-3,5-dimethylbenzamide (CID 103722617) is N-[2-(2-hydroxyethyl)pentyl]-3,5-dimethylbenzamide.
What is the SMILES notation for N-[2-(2-hydroxyethyl)pentyl]-3,5-dimethylbenzamide?
The canonical SMILES for N-[2-(2-hydroxyethyl)pentyl]-3,5-dimethylbenzamide is CCCC(CCO)CNC(=O)c1cc(C)cc(C)c1.
What is the InChIKey of N-[2-(2-hydroxyethyl)pentyl]-3,5-dimethylbenzamide?
The InChIKey is TZWHHUXNLPXSIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-4-5-14(6-7-18)11-17-16(19)15-9-12(2)8-13(3)10-15/h8-10,14,18H,4-7,11H2,1-3H3,(H,17,19).
What are the key properties of N-[2-(2-hydroxyethyl)pentyl]-3,5-dimethylbenzamide?
N-[2-(2-hydroxyethyl)pentyl]-3,5-dimethylbenzamide has a molecular weight of 263.38 g/mol, XLogP of 2.83, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-hydroxyethyl)pentyl]-3,5-dimethylbenzamide is sourced from PubChem (CID 103722617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).