2-(4-fluorophenyl)-N-methyl-N-(4-oxocyclohexyl)acetamide

C15H18FNO2 — CID 79120059

IUPAC2-(4-fluorophenyl)-N-methyl-N-(4-oxocyclohexyl)acetamide
SMILESCN(C(=O)Cc1ccc(F)cc1)C1CCC(=O)CC1
InChIInChI=1S/C15H18FNO2/c1-17(13-6-8-14(18)9-7-13)15(19)10-11-2-4-12(16)5-3-11/h2-5,13H,6-10H2,1H3
InChIKeyJWSGERVOYVXXDG-UHFFFAOYSA-N
MW263.31 g/mol
LogP2.34
Rot. Bonds3

About 2-(4-fluorophenyl)-N-methyl-N-(4-oxocyclohexyl)acetamide

2-(4-fluorophenyl)-N-methyl-N-(4-oxocyclohexyl)acetamide (PubChem CID 79120059) has the molecular formula C15H18FNO2 and a molecular weight of 263.31 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-N-methyl-N-(4-oxocyclohexyl)acetamide.

Molecular Properties

Compound Name2-(4-fluorophenyl)-N-methyl-N-(4-oxocyclohexyl)acetamide
PubChem CID79120059
Molecular FormulaC15H18FNO2
Molecular Weight263.31 g/mol
Exact Mass263.13
IUPAC Name2-(4-fluorophenyl)-N-methyl-N-(4-oxocyclohexyl)acetamide
SMILESCN(C(=O)Cc1ccc(F)cc1)C1CCC(=O)CC1
InChIInChI=1S/C15H18FNO2/c1-17(13-6-8-14(18)9-7-13)15(19)10-11-2-4-12(16)5-3-11/h2-5,13H,6-10H2,1H3
InChIKeyJWSGERVOYVXXDG-UHFFFAOYSA-N
XLogP2.34
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.31
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-aminophenyl)-N-cyclopropyl-N-methylacetamide
CID 43264480
N-cyclopentyl-N-ethyl-2-(4-fluorophenyl)acetamide
CID 86926966
2-(4-aminophenyl)-N-cyclobutyl-N-methylacetamide
CID 115739567
2,5-difluoro-N-methyl-N-(4-oxocyclohexyl)benzamide
CID 79120708
2-(4-bromo-3-fluorophenyl)-N-cyclopropyl-N-methylacetamide
CID 176515895
2-(4-carbamothioylphenyl)-N-cyclopentyl-N-methylacetamide
CID 63590526
N-methyl-N-(4-oxocyclohexyl)butanamide
CID 79120295
2-[(7S)-7-[[2-(4-fluorophenyl)acetyl]-methylamino]-6,7,8,9-tetrahydropyrido[1,2-a]indol-10-yl]acetic acid
CID 58349690
5-fluoro-N-methyl-N-(4-oxocyclohexyl)pyridine-2-carboxamide
CID 104638616
N-(1-ethylpiperidin-4-yl)-N-methyl-2-(4-sulfanylphenyl)acetamide
CID 107026586
N-methyl-2-[(2-methylpropan-2-yl)oxy]-N-(4-oxocyclohexyl)acetamide
CID 112602797
N-[4-[[benzenesulfonyl-[(4-fluorophenyl)methyl]amino]methyl]cyclohexyl]-N-methyl-2-phenylacetamide
CID 23582317

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-N-methyl-N-(4-oxocyclohexyl)acetamide?
The IUPAC name of 2-(4-fluorophenyl)-N-methyl-N-(4-oxocyclohexyl)acetamide (CID 79120059) is 2-(4-fluorophenyl)-N-methyl-N-(4-oxocyclohexyl)acetamide.
What is the SMILES notation for 2-(4-fluorophenyl)-N-methyl-N-(4-oxocyclohexyl)acetamide?
The canonical SMILES for 2-(4-fluorophenyl)-N-methyl-N-(4-oxocyclohexyl)acetamide is CN(C(=O)Cc1ccc(F)cc1)C1CCC(=O)CC1.
What is the InChIKey of 2-(4-fluorophenyl)-N-methyl-N-(4-oxocyclohexyl)acetamide?
The InChIKey is JWSGERVOYVXXDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FNO2/c1-17(13-6-8-14(18)9-7-13)15(19)10-11-2-4-12(16)5-3-11/h2-5,13H,6-10H2,1H3.
What are the key properties of 2-(4-fluorophenyl)-N-methyl-N-(4-oxocyclohexyl)acetamide?
2-(4-fluorophenyl)-N-methyl-N-(4-oxocyclohexyl)acetamide has a molecular weight of 263.31 g/mol, XLogP of 2.34, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-N-methyl-N-(4-oxocyclohexyl)acetamide is sourced from PubChem (CID 79120059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).