2-(3-hydroxyphenyl)-N-(4-methylcycloheptyl)acetamide

C16H23NO2 — CID 102809381

IUPAC2-(3-hydroxyphenyl)-N-(4-methylcycloheptyl)acetamide
SMILESCC1CCCC(NC(=O)Cc2cccc(O)c2)CC1
InChIInChI=1S/C16H23NO2/c1-12-4-2-6-14(9-8-12)17-16(19)11-13-5-3-7-15(18)10-13/h3,5,7,10,12,14,18H,2,4,6,8-9,11H2,1H3,(H,17,19)
InChIKeyRYBAOVAMRHEAES-UHFFFAOYSA-N
MW261.36 g/mol
LogP3.02
Rot. Bonds3

About 2-(3-hydroxyphenyl)-N-(4-methylcycloheptyl)acetamide

2-(3-hydroxyphenyl)-N-(4-methylcycloheptyl)acetamide (PubChem CID 102809381) has the molecular formula C16H23NO2 and a molecular weight of 261.36 g/mol. Its IUPAC name is 2-(3-hydroxyphenyl)-N-(4-methylcycloheptyl)acetamide.

Molecular Properties

Compound Name2-(3-hydroxyphenyl)-N-(4-methylcycloheptyl)acetamide
PubChem CID102809381
Molecular FormulaC16H23NO2
Molecular Weight261.36 g/mol
Exact Mass261.17
IUPAC Name2-(3-hydroxyphenyl)-N-(4-methylcycloheptyl)acetamide
SMILESCC1CCCC(NC(=O)Cc2cccc(O)c2)CC1
InChIInChI=1S/C16H23NO2/c1-12-4-2-6-14(9-8-12)17-16(19)11-13-5-3-7-15(18)10-13/h3,5,7,10,12,14,18H,2,4,6,8-9,11H2,1H3,(H,17,19)
InChIKeyRYBAOVAMRHEAES-UHFFFAOYSA-N
XLogP3.02
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 ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-fluorophenyl)-N-(4-methylcyclohexyl)acetamide
CID 78786047
2-(3-hydroxyphenyl)-N-(2-methylcyclopentyl)acetamide
CID 63279410
2-(3-hydroxyphenyl)-N-(thian-3-yl)acetamide
CID 115675030
2-(3-aminophenyl)-N-[(1R,3R)-3-methylcyclohexyl]acetamide
CID 28689697
N-(1,1-dioxothian-3-yl)-2-(3-hydroxyphenyl)acetamide
CID 63921976
N-[(1S,3S)-3-ethylsulfanylcyclopentyl]-2-(3-hydroxyphenyl)acetamide
CID 95990381
N-cyclohexyl-2-(3-methylphenyl)acetamide
CID 6467373
N-(2,3-dimethylcyclopentyl)-2-(3-hydroxyphenyl)acetamide
CID 64921822
1-(2,6-dimethylpiperidin-1-yl)-2-(3-hydroxyphenyl)ethanone
CID 61399740
2-(3-bromophenyl)-N-cyclopentylacetamide
CID 62605138
2-(3-aminophenyl)-N-cyclohexylacetamide
CID 28689689
N-(4-methylcyclohexyl)-3-phenylpropanamide
CID 78786023

Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxyphenyl)-N-(4-methylcycloheptyl)acetamide?
The IUPAC name of 2-(3-hydroxyphenyl)-N-(4-methylcycloheptyl)acetamide (CID 102809381) is 2-(3-hydroxyphenyl)-N-(4-methylcycloheptyl)acetamide.
What is the SMILES notation for 2-(3-hydroxyphenyl)-N-(4-methylcycloheptyl)acetamide?
The canonical SMILES for 2-(3-hydroxyphenyl)-N-(4-methylcycloheptyl)acetamide is CC1CCCC(NC(=O)Cc2cccc(O)c2)CC1.
What is the InChIKey of 2-(3-hydroxyphenyl)-N-(4-methylcycloheptyl)acetamide?
The InChIKey is RYBAOVAMRHEAES-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO2/c1-12-4-2-6-14(9-8-12)17-16(19)11-13-5-3-7-15(18)10-13/h3,5,7,10,12,14,18H,2,4,6,8-9,11H2,1H3,(H,17,19).
What are the key properties of 2-(3-hydroxyphenyl)-N-(4-methylcycloheptyl)acetamide?
2-(3-hydroxyphenyl)-N-(4-methylcycloheptyl)acetamide has a molecular weight of 261.36 g/mol, XLogP of 3.02, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxyphenyl)-N-(4-methylcycloheptyl)acetamide is sourced from PubChem (CID 102809381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).