1-(cyclopropylmethyl)-4-(4-methylcyclohexyl)benzene

C17H24 — CID 163396253

IUPAC1-(cyclopropylmethyl)-4-(4-methylcyclohexyl)benzene
SMILESCC1CCC(c2ccc(CC3CC3)cc2)CC1
InChIInChI=1S/C17H24/c1-13-2-8-16(9-3-13)17-10-6-15(7-11-17)12-14-4-5-14/h6-7,10-11,13-14,16H,2-5,8-9,12H2,1H3
InChIKeyMIUYJRJYFPSIAG-UHFFFAOYSA-N
MW228.38 g/mol
LogP4.93
Rot. Bonds3

About 1-(cyclopropylmethyl)-4-(4-methylcyclohexyl)benzene

1-(cyclopropylmethyl)-4-(4-methylcyclohexyl)benzene (PubChem CID 163396253) has the molecular formula C17H24 and a molecular weight of 228.38 g/mol. Its IUPAC name is 1-(cyclopropylmethyl)-4-(4-methylcyclohexyl)benzene.

Molecular Properties

Compound Name1-(cyclopropylmethyl)-4-(4-methylcyclohexyl)benzene
PubChem CID163396253
Molecular FormulaC17H24
Molecular Weight228.38 g/mol
Exact Mass228.19
IUPAC Name1-(cyclopropylmethyl)-4-(4-methylcyclohexyl)benzene
SMILESCC1CCC(c2ccc(CC3CC3)cc2)CC1
InChIInChI=1S/C17H24/c1-13-2-8-16(9-3-13)17-10-6-15(7-11-17)12-14-4-5-14/h6-7,10-11,13-14,16H,2-5,8-9,12H2,1H3
InChIKeyMIUYJRJYFPSIAG-UHFFFAOYSA-N
XLogP4.93
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 54.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

fluoromethane;1-(4-methylcyclohexyl)-4-[4-[(4-methylcyclohexyl)methyl]phenyl]benzene
CID 90971028
1,4-bis[(4-methylcyclohexyl)methyl]benzene;ethane
CID 91321679
1-(cyclopentylmethyl)-4-(4-propylcyclohexyl)benzene
CID 71773137
1-methyl-4-[2-[4-(4-methylcyclohexyl)phenyl]ethyl]benzene
CID 20579999
1-[(4-ethylcyclohexyl)methyl]-4-[[4-[(4-methylcyclohexyl)methyl]phenyl]methyl]benzene
CID 59265507
4-[4-[(4-heptylphenyl)methyl]cyclohexyl]aniline
CID 70181436
4-[4-[(4-hexylphenyl)methyl]cyclohexyl]aniline
CID 70180529
ethane;1-ethyl-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene
CID 144529338
1-(4-methylcyclohexyl)-4-(4-pentylcyclohexyl)benzene
CID 20538217
4-[[4-[4-[(4-butylphenyl)methyl]cyclohexyl]phenyl]methyl]aniline
CID 70181441
1-ethoxy-4-[(4-methylcyclohexyl)methyl]benzene
CID 134391078
ethane;methane;1-methyl-4-[[4-[[4-(4-methylcyclohexyl)phenyl]methyl]phenyl]methyl]benzene
CID 158300950

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethyl)-4-(4-methylcyclohexyl)benzene?
The IUPAC name of 1-(cyclopropylmethyl)-4-(4-methylcyclohexyl)benzene (CID 163396253) is 1-(cyclopropylmethyl)-4-(4-methylcyclohexyl)benzene.
What is the SMILES notation for 1-(cyclopropylmethyl)-4-(4-methylcyclohexyl)benzene?
The canonical SMILES for 1-(cyclopropylmethyl)-4-(4-methylcyclohexyl)benzene is CC1CCC(c2ccc(CC3CC3)cc2)CC1.
What is the InChIKey of 1-(cyclopropylmethyl)-4-(4-methylcyclohexyl)benzene?
The InChIKey is MIUYJRJYFPSIAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24/c1-13-2-8-16(9-3-13)17-10-6-15(7-11-17)12-14-4-5-14/h6-7,10-11,13-14,16H,2-5,8-9,12H2,1H3.
What are the key properties of 1-(cyclopropylmethyl)-4-(4-methylcyclohexyl)benzene?
1-(cyclopropylmethyl)-4-(4-methylcyclohexyl)benzene has a molecular weight of 228.38 g/mol, XLogP of 4.93, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethyl)-4-(4-methylcyclohexyl)benzene is sourced from PubChem (CID 163396253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).