1-methoxy-4-(4-prop-1-enylcyclohexyl)benzene

C16H22O — CID 123745381

IUPAC1-methoxy-4-(4-prop-1-enylcyclohexyl)benzene
SMILESCC=CC1CCC(c2ccc(OC)cc2)CC1
InChIInChI=1S/C16H22O/c1-3-4-13-5-7-14(8-6-13)15-9-11-16(17-2)12-10-15/h3-4,9-14H,5-8H2,1-2H3
InChIKeyAHRGQGCIOGCNGO-UHFFFAOYSA-N
MW230.35 g/mol
LogP4.55
Rot. Bonds3

About 1-methoxy-4-(4-prop-1-enylcyclohexyl)benzene

1-methoxy-4-(4-prop-1-enylcyclohexyl)benzene (PubChem CID 123745381) has the molecular formula C16H22O and a molecular weight of 230.35 g/mol. Its IUPAC name is 1-methoxy-4-(4-prop-1-enylcyclohexyl)benzene.

Molecular Properties

Compound Name1-methoxy-4-(4-prop-1-enylcyclohexyl)benzene
PubChem CID123745381
Molecular FormulaC16H22O
Molecular Weight230.35 g/mol
Exact Mass230.17
IUPAC Name1-methoxy-4-(4-prop-1-enylcyclohexyl)benzene
SMILESCC=CC1CCC(c2ccc(OC)cc2)CC1
InChIInChI=1S/C16H22O/c1-3-4-13-5-7-14(8-6-13)15-9-11-16(17-2)12-10-15/h3-4,9-14H,5-8H2,1-2H3
InChIKeyAHRGQGCIOGCNGO-UHFFFAOYSA-N
XLogP4.55
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1-methoxy-4-[4-[(E)-2-[4-[(E)-prop-1-enyl]cyclohexyl]ethenyl]cyclohexyl]benzene;molecular hydrogen
CID 160964555
2-(4-methoxyphenyl)-6-[(E)-prop-1-enyl]-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
CID 22385090
4-[2-[4-(4-methoxyphenyl)cyclohexyl]ethenyl]-N-methylcyclohexan-1-amine
CID 71173126
1-[4-[(E)-2-[4-[(E)-prop-1-enyl]cyclohexyl]ethenyl]cyclohexyl]-4-(trifluoromethoxy)benzene
CID 59734847
ethane;1-(4-methylcyclohexyl)-4-[4-[(E)-prop-1-enyl]cyclohexyl]benzene
CID 90684814
1-methoxy-4-(4-methylcyclohexyl)benzene;hydrate
CID 144745908
1,2-difluoro-3-methoxy-7-[4-[(E)-prop-1-enyl]cyclohexyl]naphthalene
CID 139863353
4-[4-[(E)-prop-1-enyl]cyclohexyl]benzoic acid
CID 19938016
2-ethyl-6-[4-[4-[(E)-prop-1-enyl]cyclohexyl]phenyl]naphthalene
CID 139860723
1-methyl-4-[2-[4-[4-[(Z)-prop-1-enyl]cyclohexyl]phenyl]ethynyl]benzene
CID 173280840
bromomethane;1-cyclopentyl-4-methoxybenzene
CID 160663013
1-(4,4-dimethylcyclohexyl)-4-methoxybenzene
CID 18414650

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-4-(4-prop-1-enylcyclohexyl)benzene?
The IUPAC name of 1-methoxy-4-(4-prop-1-enylcyclohexyl)benzene (CID 123745381) is 1-methoxy-4-(4-prop-1-enylcyclohexyl)benzene.
What is the SMILES notation for 1-methoxy-4-(4-prop-1-enylcyclohexyl)benzene?
The canonical SMILES for 1-methoxy-4-(4-prop-1-enylcyclohexyl)benzene is CC=CC1CCC(c2ccc(OC)cc2)CC1.
What is the InChIKey of 1-methoxy-4-(4-prop-1-enylcyclohexyl)benzene?
The InChIKey is AHRGQGCIOGCNGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22O/c1-3-4-13-5-7-14(8-6-13)15-9-11-16(17-2)12-10-15/h3-4,9-14H,5-8H2,1-2H3.
What are the key properties of 1-methoxy-4-(4-prop-1-enylcyclohexyl)benzene?
1-methoxy-4-(4-prop-1-enylcyclohexyl)benzene has a molecular weight of 230.35 g/mol, XLogP of 4.55, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-4-(4-prop-1-enylcyclohexyl)benzene is sourced from PubChem (CID 123745381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).