N-(3-ethyl-2-methylcyclopentyl)-3-hydroxy-2-methylbenzamide

C16H23NO2 — CID 82829272

IUPACN-(3-ethyl-2-methylcyclopentyl)-3-hydroxy-2-methylbenzamide
SMILESCCC1CCC(NC(=O)c2cccc(O)c2C)C1C
InChIInChI=1S/C16H23NO2/c1-4-12-8-9-14(10(12)2)17-16(19)13-6-5-7-15(18)11(13)3/h5-7,10,12,14,18H,4,8-9H2,1-3H3,(H,17,19)
InChIKeyLVXGGBHBUHXJCN-UHFFFAOYSA-N
MW261.36 g/mol
LogP3.26
Rot. Bonds3

About N-(3-ethyl-2-methylcyclopentyl)-3-hydroxy-2-methylbenzamide

N-(3-ethyl-2-methylcyclopentyl)-3-hydroxy-2-methylbenzamide (PubChem CID 82829272) has the molecular formula C16H23NO2 and a molecular weight of 261.36 g/mol. Its IUPAC name is N-(3-ethyl-2-methylcyclopentyl)-3-hydroxy-2-methylbenzamide.

Molecular Properties

Compound NameN-(3-ethyl-2-methylcyclopentyl)-3-hydroxy-2-methylbenzamide
PubChem CID82829272
Molecular FormulaC16H23NO2
Molecular Weight261.36 g/mol
Exact Mass261.17
IUPAC NameN-(3-ethyl-2-methylcyclopentyl)-3-hydroxy-2-methylbenzamide
SMILESCCC1CCC(NC(=O)c2cccc(O)c2C)C1C
InChIInChI=1S/C16H23NO2/c1-4-12-8-9-14(10(12)2)17-16(19)13-6-5-7-15(18)11(13)3/h5-7,10,12,14,18H,4,8-9H2,1-3H3,(H,17,19)
InChIKeyLVXGGBHBUHXJCN-UHFFFAOYSA-N
XLogP3.26
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.36
LogP ≤ 53.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-(3-ethyl-2-methylcyclopentyl)-3-methylbenzamide
CID 64923284
2-amino-N-(3-ethyl-2-methylcyclopentyl)pyridine-3-carboxamide
CID 64915258
2-amino-3-chloro-N-(3-ethyl-2-methylcyclopentyl)benzamide
CID 115540774
3-hydroxy-2-methyl-N-(2-propylcyclopropyl)benzamide
CID 103873583
N-(3-ethyl-2-methylcyclopentyl)-4-hydroxy-3-methylbenzamide
CID 107676725
2-amino-N-(3-ethyl-2-methylcyclopentyl)-6-methylbenzamide
CID 64923476
3-hydroxy-2-methyl-N-(2-methylcycloheptyl)benzamide
CID 82829354
3-hydroxy-2-methyl-N-(2-methyloxolan-3-yl)benzamide
CID 82829597
N-(3-ethyl-2-methylcyclopentyl)-2-hydrazinyl-5-methylbenzamide
CID 64914858
N-(2-bicyclo[2.2.1]heptanyl)-3-hydroxy-2-methylbenzamide
CID 82829980
2-[(3-hydroxy-2-methylbenzoyl)amino]cycloheptane-1-carboxylic acid
CID 82809247
2,4-diamino-N-(3-ethyl-2-methylcyclopentyl)benzamide
CID 64921700

Frequently Asked Questions

What is the IUPAC name of N-(3-ethyl-2-methylcyclopentyl)-3-hydroxy-2-methylbenzamide?
The IUPAC name of N-(3-ethyl-2-methylcyclopentyl)-3-hydroxy-2-methylbenzamide (CID 82829272) is N-(3-ethyl-2-methylcyclopentyl)-3-hydroxy-2-methylbenzamide.
What is the SMILES notation for N-(3-ethyl-2-methylcyclopentyl)-3-hydroxy-2-methylbenzamide?
The canonical SMILES for N-(3-ethyl-2-methylcyclopentyl)-3-hydroxy-2-methylbenzamide is CCC1CCC(NC(=O)c2cccc(O)c2C)C1C.
What is the InChIKey of N-(3-ethyl-2-methylcyclopentyl)-3-hydroxy-2-methylbenzamide?
The InChIKey is LVXGGBHBUHXJCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO2/c1-4-12-8-9-14(10(12)2)17-16(19)13-6-5-7-15(18)11(13)3/h5-7,10,12,14,18H,4,8-9H2,1-3H3,(H,17,19).
What are the key properties of N-(3-ethyl-2-methylcyclopentyl)-3-hydroxy-2-methylbenzamide?
N-(3-ethyl-2-methylcyclopentyl)-3-hydroxy-2-methylbenzamide has a molecular weight of 261.36 g/mol, XLogP of 3.26, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethyl-2-methylcyclopentyl)-3-hydroxy-2-methylbenzamide is sourced from PubChem (CID 82829272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).