(4-fluoro-2-methylphenyl)-(4-methylcyclohexyl)methanone

C15H19FO — CID 62790629

IUPAC(4-fluoro-2-methylphenyl)-(4-methylcyclohexyl)methanone
SMILESCc1cc(F)ccc1C(=O)C1CCC(C)CC1
InChIInChI=1S/C15H19FO/c1-10-3-5-12(6-4-10)15(17)14-8-7-13(16)9-11(14)2/h7-10,12H,3-6H2,1-2H3
InChIKeyNIHVYUKUUYGLOQ-UHFFFAOYSA-N
MW234.31 g/mol
LogP4.14
Rot. Bonds2

About (4-fluoro-2-methylphenyl)-(4-methylcyclohexyl)methanone

(4-fluoro-2-methylphenyl)-(4-methylcyclohexyl)methanone (PubChem CID 62790629) has the molecular formula C15H19FO and a molecular weight of 234.31 g/mol. Its IUPAC name is (4-fluoro-2-methylphenyl)-(4-methylcyclohexyl)methanone.

Molecular Properties

Compound Name(4-fluoro-2-methylphenyl)-(4-methylcyclohexyl)methanone
PubChem CID62790629
Molecular FormulaC15H19FO
Molecular Weight234.31 g/mol
Exact Mass234.14
IUPAC Name(4-fluoro-2-methylphenyl)-(4-methylcyclohexyl)methanone
SMILESCc1cc(F)ccc1C(=O)C1CCC(C)CC1
InChIInChI=1S/C15H19FO/c1-10-3-5-12(6-4-10)15(17)14-8-7-13(16)9-11(14)2/h7-10,12H,3-6H2,1-2H3
InChIKeyNIHVYUKUUYGLOQ-UHFFFAOYSA-N
XLogP4.14
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.31
LogP ≤ 54.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (4-fluoro-2-methylphenyl)-(4-methylcyclohexyl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2,5-difluorophenyl)-(4-methylcyclohexyl)methanone
CID 55120292
(4-fluoro-2-methylphenyl)-(oxolan-3-yl)methanone
CID 65330614
2,3-dihydro-1H-inden-2-yl-(4-fluoro-2-methylphenyl)methanone
CID 65406838
[4-(2,3-difluoro-4-methylphenyl)-2,3-difluorophenyl]-(4-methylcyclohexyl)methanone
CID 134358800
(4-fluoro-3-methylphenyl)-(4-methylcyclohexyl)methanone
CID 62790630
(4-fluoro-2-methylphenyl)-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)methanone
CID 171945077
(3-ethylcyclohexyl)-(4-fluoro-2-methylphenyl)methanone
CID 65401304
[(2S,6R)-2,6-dimethylpiperidin-1-yl]-(4-fluoro-2-methylphenyl)methanone
CID 103820381
(5-chloro-2-methylphenyl)-(4-methylcyclohexyl)methanone
CID 114975097
(2-aminocyclohexyl)-(4-fluoro-2-methylphenyl)methanone
CID 116580026
(5-fluoro-2-methylphenyl)-[4-(trifluoromethyl)cyclohexyl]methanone
CID 105095429
(2-fluoro-4-methoxyphenyl)-(4-methylcyclohexyl)methanone
CID 81304901

Frequently Asked Questions

What is the IUPAC name of (4-fluoro-2-methylphenyl)-(4-methylcyclohexyl)methanone?
The IUPAC name of (4-fluoro-2-methylphenyl)-(4-methylcyclohexyl)methanone (CID 62790629) is (4-fluoro-2-methylphenyl)-(4-methylcyclohexyl)methanone.
What is the SMILES notation for (4-fluoro-2-methylphenyl)-(4-methylcyclohexyl)methanone?
The canonical SMILES for (4-fluoro-2-methylphenyl)-(4-methylcyclohexyl)methanone is Cc1cc(F)ccc1C(=O)C1CCC(C)CC1.
What is the InChIKey of (4-fluoro-2-methylphenyl)-(4-methylcyclohexyl)methanone?
The InChIKey is NIHVYUKUUYGLOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FO/c1-10-3-5-12(6-4-10)15(17)14-8-7-13(16)9-11(14)2/h7-10,12H,3-6H2,1-2H3.
What are the key properties of (4-fluoro-2-methylphenyl)-(4-methylcyclohexyl)methanone?
(4-fluoro-2-methylphenyl)-(4-methylcyclohexyl)methanone has a molecular weight of 234.31 g/mol, XLogP of 4.14, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluoro-2-methylphenyl)-(4-methylcyclohexyl)methanone is sourced from PubChem (CID 62790629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).