1-(cyclopropylmethoxy)-4-(4-methylcyclohexyl)benzene

C17H24O — CID 21137247

IUPAC1-(cyclopropylmethoxy)-4-(4-methylcyclohexyl)benzene
SMILESCC1CCC(c2ccc(OCC3CC3)cc2)CC1
InChIInChI=1S/C17H24O/c1-13-2-6-15(7-3-13)16-8-10-17(11-9-16)18-12-14-4-5-14/h8-11,13-15H,2-7,12H2,1H3
InChIKeyXSPKQHHDEKNUNM-UHFFFAOYSA-N
MW244.38 g/mol
LogP4.77
Rot. Bonds4

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

1-(cyclopropylmethoxy)-4-(4-methylcyclohexyl)benzene (PubChem CID 21137247) has the molecular formula C17H24O and a molecular weight of 244.38 g/mol. Its IUPAC name is 1-(cyclopropylmethoxy)-4-(4-methylcyclohexyl)benzene.

Molecular Properties

Compound Name1-(cyclopropylmethoxy)-4-(4-methylcyclohexyl)benzene
PubChem CID21137247
Molecular FormulaC17H24O
Molecular Weight244.38 g/mol
Exact Mass244.18
IUPAC Name1-(cyclopropylmethoxy)-4-(4-methylcyclohexyl)benzene
SMILESCC1CCC(c2ccc(OCC3CC3)cc2)CC1
InChIInChI=1S/C17H24O/c1-13-2-6-15(7-3-13)16-8-10-17(11-9-16)18-12-14-4-5-14/h8-11,13-15H,2-7,12H2,1H3
InChIKeyXSPKQHHDEKNUNM-UHFFFAOYSA-N
XLogP4.77
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 54.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-(cyclopropylmethoxy)-4-(4-methylcyclohexyl)benzene 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

4-[4-(cyclohexylmethoxy)phenyl]cyclohexan-1-ol
CID 129014399
methanethiol;1-methyl-4-[[4-(4-methylcyclohexyl)cyclohexyl]methoxy]benzene
CID 144724148
1-methoxy-4-[[4-(4-methylcyclohexyl)phenyl]methoxy]benzene
CID 118595910
1-(4-methylcyclohexyl)-4-[2-(4-propoxyphenyl)ethynyl]benzene
CID 58933295
CID 163366927
CID 163366927
1-methoxy-4-(4-methylcyclohexyl)benzene;hydrate
CID 144745908
tribromo-[3-[4-(4-methylcyclohexyl)phenoxy]propyl]silane
CID 18612110
1-(cyclopropylmethyl)-4-(4-methylcyclohexyl)benzene
CID 163396253
1-(4-butylcyclohexyl)-4-ethoxybenzene
CID 3019938
1-[(E)-1,2-difluoro-2-[4-(4-methylcyclohexyl)phenyl]ethenyl]-4-ethoxybenzene
CID 139790644
4-(4-methylcyclohexyl)benzonitrile
CID 18464047
1-(4-methylcyclohexyl)-4-(4-pentylcyclohexyl)benzene
CID 20538217

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethoxy)-4-(4-methylcyclohexyl)benzene?
The IUPAC name of 1-(cyclopropylmethoxy)-4-(4-methylcyclohexyl)benzene (CID 21137247) is 1-(cyclopropylmethoxy)-4-(4-methylcyclohexyl)benzene.
What is the SMILES notation for 1-(cyclopropylmethoxy)-4-(4-methylcyclohexyl)benzene?
The canonical SMILES for 1-(cyclopropylmethoxy)-4-(4-methylcyclohexyl)benzene is CC1CCC(c2ccc(OCC3CC3)cc2)CC1.
What is the InChIKey of 1-(cyclopropylmethoxy)-4-(4-methylcyclohexyl)benzene?
The InChIKey is XSPKQHHDEKNUNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24O/c1-13-2-6-15(7-3-13)16-8-10-17(11-9-16)18-12-14-4-5-14/h8-11,13-15H,2-7,12H2,1H3.
What are the key properties of 1-(cyclopropylmethoxy)-4-(4-methylcyclohexyl)benzene?
1-(cyclopropylmethoxy)-4-(4-methylcyclohexyl)benzene has a molecular weight of 244.38 g/mol, XLogP of 4.77, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethoxy)-4-(4-methylcyclohexyl)benzene is sourced from PubChem (CID 21137247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).