2-(3-fluorophenyl)-N-(4-methylcyclohexyl)acetamide

C15H20FNO — CID 78786047

IUPAC2-(3-fluorophenyl)-N-(4-methylcyclohexyl)acetamide
SMILESCC1CCC(NC(=O)Cc2cccc(F)c2)CC1
InChIInChI=1S/C15H20FNO/c1-11-5-7-14(8-6-11)17-15(18)10-12-3-2-4-13(16)9-12/h2-4,9,11,14H,5-8,10H2,1H3,(H,17,18)
InChIKeyZDPGIZLJGJWTFF-UHFFFAOYSA-N
MW249.33 g/mol
LogP3.06
Rot. Bonds3

About 2-(3-fluorophenyl)-N-(4-methylcyclohexyl)acetamide

2-(3-fluorophenyl)-N-(4-methylcyclohexyl)acetamide (PubChem CID 78786047) has the molecular formula C15H20FNO and a molecular weight of 249.33 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-N-(4-methylcyclohexyl)acetamide.

Molecular Properties

Compound Name2-(3-fluorophenyl)-N-(4-methylcyclohexyl)acetamide
PubChem CID78786047
Molecular FormulaC15H20FNO
Molecular Weight249.33 g/mol
Exact Mass249.15
IUPAC Name2-(3-fluorophenyl)-N-(4-methylcyclohexyl)acetamide
SMILESCC1CCC(NC(=O)Cc2cccc(F)c2)CC1
InChIInChI=1S/C15H20FNO/c1-11-5-7-14(8-6-11)17-15(18)10-12-3-2-4-13(16)9-12/h2-4,9,11,14H,5-8,10H2,1H3,(H,17,18)
InChIKeyZDPGIZLJGJWTFF-UHFFFAOYSA-N
XLogP3.06
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.33
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(4-chlorocyclohexyl)-2-(3-fluorophenyl)acetamide
CID 114296854
methyl 4-[[2-(3-fluorophenyl)acetyl]amino]cyclohexane-1-carboxylate
CID 115617162
N-(4-aminocyclohexyl)-2-(3-fluorophenyl)acetamide;hydrochloride
CID 119260253
4-[[2-(3-fluorophenyl)acetyl]amino]cyclohexane-1-carboxylic acid
CID 60808861
2-(3-hydroxyphenyl)-N-(4-methylcycloheptyl)acetamide
CID 102809381
2-(3-fluorophenyl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide
CID 32541358
N-[1-[2-(3-fluorophenyl)acetyl]piperidin-4-yl]propanamide
CID 110822825
N-(1,1-dioxothiolan-3-yl)-2-(3-fluorophenyl)acetamide
CID 51240347
N-[1-(3,3-dimethylbutanoyl)piperidin-4-yl]-2-(3-fluorophenyl)acetamide
CID 110822279
2-(3-fluorophenyl)-N-[1-(3-methylbutanoyl)piperidin-4-yl]acetamide
CID 51093724
2-(3-fluorophenyl)-1-(1-hydroxy-4-methylcyclohexyl)ethanone
CID 103450824
2-(3-fluorophenyl)-N-piperidin-3-ylacetamide
CID 18071271

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-N-(4-methylcyclohexyl)acetamide?
The IUPAC name of 2-(3-fluorophenyl)-N-(4-methylcyclohexyl)acetamide (CID 78786047) is 2-(3-fluorophenyl)-N-(4-methylcyclohexyl)acetamide.
What is the SMILES notation for 2-(3-fluorophenyl)-N-(4-methylcyclohexyl)acetamide?
The canonical SMILES for 2-(3-fluorophenyl)-N-(4-methylcyclohexyl)acetamide is CC1CCC(NC(=O)Cc2cccc(F)c2)CC1.
What is the InChIKey of 2-(3-fluorophenyl)-N-(4-methylcyclohexyl)acetamide?
The InChIKey is ZDPGIZLJGJWTFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FNO/c1-11-5-7-14(8-6-11)17-15(18)10-12-3-2-4-13(16)9-12/h2-4,9,11,14H,5-8,10H2,1H3,(H,17,18).
What are the key properties of 2-(3-fluorophenyl)-N-(4-methylcyclohexyl)acetamide?
2-(3-fluorophenyl)-N-(4-methylcyclohexyl)acetamide has a molecular weight of 249.33 g/mol, XLogP of 3.06, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-N-(4-methylcyclohexyl)acetamide is sourced from PubChem (CID 78786047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).