N-(2-cyclopentylethyl)-4-hydroxy-2-methylbenzamide

C15H21NO2 — CID 103865170

IUPACN-(2-cyclopentylethyl)-4-hydroxy-2-methylbenzamide
SMILESCc1cc(O)ccc1C(=O)NCCC1CCCC1
InChIInChI=1S/C15H21NO2/c1-11-10-13(17)6-7-14(11)15(18)16-9-8-12-4-2-3-5-12/h6-7,10,12,17H,2-5,8-9H2,1H3,(H,16,18)
InChIKeyLNSYSAHOVMRNBL-UHFFFAOYSA-N
MW247.34 g/mol
LogP3.01
Rot. Bonds4

About N-(2-cyclopentylethyl)-4-hydroxy-2-methylbenzamide

N-(2-cyclopentylethyl)-4-hydroxy-2-methylbenzamide (PubChem CID 103865170) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is N-(2-cyclopentylethyl)-4-hydroxy-2-methylbenzamide.

Molecular Properties

Compound NameN-(2-cyclopentylethyl)-4-hydroxy-2-methylbenzamide
PubChem CID103865170
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC NameN-(2-cyclopentylethyl)-4-hydroxy-2-methylbenzamide
SMILESCc1cc(O)ccc1C(=O)NCCC1CCCC1
InChIInChI=1S/C15H21NO2/c1-11-10-13(17)6-7-14(11)15(18)16-9-8-12-4-2-3-5-12/h6-7,10,12,17H,2-5,8-9H2,1H3,(H,16,18)
InChIKeyLNSYSAHOVMRNBL-UHFFFAOYSA-N
XLogP3.01
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentylethyl)-4-hydroxy-2-methylbenzamide?
The IUPAC name of N-(2-cyclopentylethyl)-4-hydroxy-2-methylbenzamide (CID 103865170) is N-(2-cyclopentylethyl)-4-hydroxy-2-methylbenzamide.
What is the SMILES notation for N-(2-cyclopentylethyl)-4-hydroxy-2-methylbenzamide?
The canonical SMILES for N-(2-cyclopentylethyl)-4-hydroxy-2-methylbenzamide is Cc1cc(O)ccc1C(=O)NCCC1CCCC1.
What is the InChIKey of N-(2-cyclopentylethyl)-4-hydroxy-2-methylbenzamide?
The InChIKey is LNSYSAHOVMRNBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-11-10-13(17)6-7-14(11)15(18)16-9-8-12-4-2-3-5-12/h6-7,10,12,17H,2-5,8-9H2,1H3,(H,16,18).
What are the key properties of N-(2-cyclopentylethyl)-4-hydroxy-2-methylbenzamide?
N-(2-cyclopentylethyl)-4-hydroxy-2-methylbenzamide has a molecular weight of 247.34 g/mol, XLogP of 3.01, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentylethyl)-4-hydroxy-2-methylbenzamide is sourced from PubChem (CID 103865170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).