cyclohexen-1-yl-(2-methylphenyl)methanone

C14H16O — CID 62078822

IUPACcyclohexen-1-yl-(2-methylphenyl)methanone
SMILESCc1ccccc1C(=O)C1=CCCCC1
InChIInChI=1S/C14H16O/c1-11-7-5-6-10-13(11)14(15)12-8-3-2-4-9-12/h5-8,10H,2-4,9H2,1H3
InChIKeyKGLUUGJNEUVXQT-UHFFFAOYSA-N
MW200.28 g/mol
LogP3.68
Rot. Bonds2

About cyclohexen-1-yl-(2-methylphenyl)methanone

cyclohexen-1-yl-(2-methylphenyl)methanone (PubChem CID 62078822) has the molecular formula C14H16O and a molecular weight of 200.28 g/mol. Its IUPAC name is cyclohexen-1-yl-(2-methylphenyl)methanone.

Molecular Properties

Compound Namecyclohexen-1-yl-(2-methylphenyl)methanone
PubChem CID62078822
Molecular FormulaC14H16O
Molecular Weight200.28 g/mol
Exact Mass200.12
IUPAC Namecyclohexen-1-yl-(2-methylphenyl)methanone
SMILESCc1ccccc1C(=O)C1=CCCCC1
InChIInChI=1S/C14H16O/c1-11-7-5-6-10-13(11)14(15)12-8-3-2-4-9-12/h5-8,10H,2-4,9H2,1H3
InChIKeyKGLUUGJNEUVXQT-UHFFFAOYSA-N
XLogP3.68
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

[(1E)-cycloocten-1-yl]-(2-methylphenyl)methanone
CID 106651753
cyclopenten-1-yl-(2,3-dimethylphenyl)methanone
CID 62080312
(2-bromo-3-methylphenyl)-[(1E)-cycloocten-1-yl]methanone
CID 107984675
cyclopenten-1-yl-(2-fluoro-3-methylphenyl)methanone
CID 81481190
cyclohexen-1-yl-(3-methyl-4-pyridinyl)methanone
CID 106652156
cyclohexen-1-yl-(2,4,5-trimethylphenyl)methanone
CID 103449982
cyclohexen-1-yl-(2-propan-2-yloxyphenyl)methanone
CID 103449936
cyclohexen-1-yl-(2-methylthiophen-3-yl)methanone
CID 103449971
(3-chloro-2-methylphenyl)-(cyclopenten-1-yl)methanone
CID 107096169
1-(cyclohexen-1-yl)-2-(2-methylphenyl)ethanone
CID 62077966
[(1E)-cycloocten-1-yl]-(2-methylfuran-3-yl)methanone
CID 106652204
cyclohepten-1-yl-[2-(2-methoxyethoxy)phenyl]methanone
CID 103450486

Frequently Asked Questions

What is the IUPAC name of cyclohexen-1-yl-(2-methylphenyl)methanone?
The IUPAC name of cyclohexen-1-yl-(2-methylphenyl)methanone (CID 62078822) is cyclohexen-1-yl-(2-methylphenyl)methanone.
What is the SMILES notation for cyclohexen-1-yl-(2-methylphenyl)methanone?
The canonical SMILES for cyclohexen-1-yl-(2-methylphenyl)methanone is Cc1ccccc1C(=O)C1=CCCCC1.
What is the InChIKey of cyclohexen-1-yl-(2-methylphenyl)methanone?
The InChIKey is KGLUUGJNEUVXQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16O/c1-11-7-5-6-10-13(11)14(15)12-8-3-2-4-9-12/h5-8,10H,2-4,9H2,1H3.
What are the key properties of cyclohexen-1-yl-(2-methylphenyl)methanone?
cyclohexen-1-yl-(2-methylphenyl)methanone has a molecular weight of 200.28 g/mol, XLogP of 3.68, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexen-1-yl-(2-methylphenyl)methanone is sourced from PubChem (CID 62078822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).