(1-methyl-4-phenylcyclohexyl)benzene

C19H22 — CID 164683262

IUPAC(1-methyl-4-phenylcyclohexyl)benzene
SMILESCC1(c2ccccc2)CCC(c2ccccc2)CC1
InChIInChI=1S/C19H22/c1-19(18-10-6-3-7-11-18)14-12-17(13-15-19)16-8-4-2-5-9-16/h2-11,17H,12-15H2,1H3
InChIKeyMVCQGEXTSONKQM-UHFFFAOYSA-N
MW250.39 g/mol
LogP5.30
Rot. Bonds2

About (1-methyl-4-phenylcyclohexyl)benzene

(1-methyl-4-phenylcyclohexyl)benzene (PubChem CID 164683262) has the molecular formula C19H22 and a molecular weight of 250.39 g/mol. Its IUPAC name is (1-methyl-4-phenylcyclohexyl)benzene.

Molecular Properties

Compound Name(1-methyl-4-phenylcyclohexyl)benzene
PubChem CID164683262
Molecular FormulaC19H22
Molecular Weight250.39 g/mol
Exact Mass250.17
IUPAC Name(1-methyl-4-phenylcyclohexyl)benzene
SMILESCC1(c2ccccc2)CCC(c2ccccc2)CC1
InChIInChI=1S/C19H22/c1-19(18-10-6-3-7-11-18)14-12-17(13-15-19)16-8-4-2-5-9-16/h2-11,17H,12-15H2,1H3
InChIKeyMVCQGEXTSONKQM-UHFFFAOYSA-N
XLogP5.30
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500250.39
LogP ≤ 55.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

6-phenylspiro[2.5]octane
CID 123640963
benzene;cyclopropylbenzene
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methanimine;(1-methylcyclopropyl)benzene
CID 163372964
methane;(1-methylcyclopentyl)benzene
CID 143499824
2-(1-methyl-4-phenylcyclohexyl)acetic acid
CID 169408960
cis-(1R,3R)-3-methyl-3-phenylcyclopentan-1-amine;hydrochloride
CID 173470709
(2,2-dimethyl-6-phenylspiro[2.5]octan-1-yl)methanol
CID 114229957
2-(4-methylphenyl)-5-(1-methyl-4-phenylcyclohexyl)-1,3,4-oxadiazole
CID 59079242
[1-methyl-4-(4-propylcyclohexyl)cyclohexyl]benzene
CID 139782194
1-methyl-4-phenylpiperidin-1-ium iodide
CID 142626805
ethane;4-methyl-4-phenylpiperidine
CID 91476557
1,1-dimethyl-8-phenyl-2-azaspiro[4.5]decan-3-one
CID 66109358

Frequently Asked Questions

What is the IUPAC name of (1-methyl-4-phenylcyclohexyl)benzene?
The IUPAC name of (1-methyl-4-phenylcyclohexyl)benzene (CID 164683262) is (1-methyl-4-phenylcyclohexyl)benzene.
What is the SMILES notation for (1-methyl-4-phenylcyclohexyl)benzene?
The canonical SMILES for (1-methyl-4-phenylcyclohexyl)benzene is CC1(c2ccccc2)CCC(c2ccccc2)CC1.
What is the InChIKey of (1-methyl-4-phenylcyclohexyl)benzene?
The InChIKey is MVCQGEXTSONKQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22/c1-19(18-10-6-3-7-11-18)14-12-17(13-15-19)16-8-4-2-5-9-16/h2-11,17H,12-15H2,1H3.
What are the key properties of (1-methyl-4-phenylcyclohexyl)benzene?
(1-methyl-4-phenylcyclohexyl)benzene has a molecular weight of 250.39 g/mol, XLogP of 5.30, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methyl-4-phenylcyclohexyl)benzene is sourced from PubChem (CID 164683262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).