2-fluoro-1-methoxy-4-[4-(4-methoxycyclohexyl)phenyl]benzene

C20H23FO2 — CID 144809360

IUPAC2-fluoro-1-methoxy-4-[4-(4-methoxycyclohexyl)phenyl]benzene
SMILESCOc1ccc(-c2ccc(C3CCC(OC)CC3)cc2)cc1F
InChIInChI=1S/C20H23FO2/c1-22-18-10-7-15(8-11-18)14-3-5-16(6-4-14)17-9-12-20(23-2)19(21)13-17/h3-6,9,12-13,15,18H,7-8,10-11H2,1-2H3
InChIKeyBLINCRZXJQZKSQ-UHFFFAOYSA-N
MW314.40 g/mol
LogP5.17
Rot. Bonds4

About 2-fluoro-1-methoxy-4-[4-(4-methoxycyclohexyl)phenyl]benzene

2-fluoro-1-methoxy-4-[4-(4-methoxycyclohexyl)phenyl]benzene (PubChem CID 144809360) has the molecular formula C20H23FO2 and a molecular weight of 314.40 g/mol. Its IUPAC name is 2-fluoro-1-methoxy-4-[4-(4-methoxycyclohexyl)phenyl]benzene.

Molecular Properties

Compound Name2-fluoro-1-methoxy-4-[4-(4-methoxycyclohexyl)phenyl]benzene
PubChem CID144809360
Molecular FormulaC20H23FO2
Molecular Weight314.40 g/mol
Exact Mass314.17
IUPAC Name2-fluoro-1-methoxy-4-[4-(4-methoxycyclohexyl)phenyl]benzene
SMILESCOc1ccc(-c2ccc(C3CCC(OC)CC3)cc2)cc1F
InChIInChI=1S/C20H23FO2/c1-22-18-10-7-15(8-11-18)14-3-5-16(6-4-14)17-9-12-20(23-2)19(21)13-17/h3-6,9,12-13,15,18H,7-8,10-11H2,1-2H3
InChIKeyBLINCRZXJQZKSQ-UHFFFAOYSA-N
XLogP5.17
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500314.40
LogP ≤ 55.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-fluoro-1-methoxy-4-[4-(4-methoxycyclohexyl)phenyl]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

2-fluoro-1-methoxy-4-[4-(4-methylcyclohexyl)phenyl]benzene
CID 144809449
1-(difluoromethoxy)-2-fluoro-4-[4-(4-methoxycyclohexyl)phenyl]benzene
CID 144809434
2-fluoro-1-(3-fluoro-4-methoxyphenyl)-4-[4-(4-methylcyclohexyl)phenyl]benzene;fluoromethane
CID 123561678
2-[4-(3-fluoro-4-methoxyphenyl)phenyl]-6-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
CID 22384938
1,2-difluoro-4-(4-methoxycyclohexyl)benzene
CID 144809444
2-fluoro-4-(4-methoxycyclohexyl)-1-[(E)-prop-1-enoxy]benzene
CID 144809408
2-[4-(3-fluoro-4-methoxyphenyl)phenyl]-6-heptyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
CID 22384278
1-ethoxy-2-fluoro-4-[4-(4-prop-2-enoxycyclohexyl)phenyl]benzene
CID 138459505
2-fluoro-4-[4-(4-methylcyclohexyl)phenyl]-1-(2-methylpropoxy)benzene
CID 144809398
2-fluoro-4-[4-(4-fluorocyclohexyl)cyclohexyl]-1-methoxybenzene
CID 18344262
1,2-difluoro-4-(3-fluoro-4-methoxyphenyl)benzene
CID 18930756
4-[4-[4-(4-but-3-enylcyclohexyl)phenyl]phenyl]-1-ethoxy-2-fluorobenzene
CID 138459506

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-1-methoxy-4-[4-(4-methoxycyclohexyl)phenyl]benzene?
The IUPAC name of 2-fluoro-1-methoxy-4-[4-(4-methoxycyclohexyl)phenyl]benzene (CID 144809360) is 2-fluoro-1-methoxy-4-[4-(4-methoxycyclohexyl)phenyl]benzene.
What is the SMILES notation for 2-fluoro-1-methoxy-4-[4-(4-methoxycyclohexyl)phenyl]benzene?
The canonical SMILES for 2-fluoro-1-methoxy-4-[4-(4-methoxycyclohexyl)phenyl]benzene is COc1ccc(-c2ccc(C3CCC(OC)CC3)cc2)cc1F.
What is the InChIKey of 2-fluoro-1-methoxy-4-[4-(4-methoxycyclohexyl)phenyl]benzene?
The InChIKey is BLINCRZXJQZKSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23FO2/c1-22-18-10-7-15(8-11-18)14-3-5-16(6-4-14)17-9-12-20(23-2)19(21)13-17/h3-6,9,12-13,15,18H,7-8,10-11H2,1-2H3.
What are the key properties of 2-fluoro-1-methoxy-4-[4-(4-methoxycyclohexyl)phenyl]benzene?
2-fluoro-1-methoxy-4-[4-(4-methoxycyclohexyl)phenyl]benzene has a molecular weight of 314.40 g/mol, XLogP of 5.17, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-1-methoxy-4-[4-(4-methoxycyclohexyl)phenyl]benzene is sourced from PubChem (CID 144809360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).