1-[(E)-2-cyclobutylethenyl]-4-cyclopropyloxy-2,3-difluorobenzene

C15H16F2O — CID 147615512

IUPAC1-[(E)-2-cyclobutylethenyl]-4-cyclopropyloxy-2,3-difluorobenzene
SMILESFc1c(/C=C/C2CCC2)ccc(OC2CC2)c1F
InChIInChI=1S/C15H16F2O/c16-14-11(5-4-10-2-1-3-10)6-9-13(15(14)17)18-12-7-8-12/h4-6,9-10,12H,1-3,7-8H2/b5-4+
InChIKeyGCVPVQGZWQOSFN-SNAWJCMRSA-N
MW250.29 g/mol
LogP4.32
Rot. Bonds4

About 1-[(E)-2-cyclobutylethenyl]-4-cyclopropyloxy-2,3-difluorobenzene

1-[(E)-2-cyclobutylethenyl]-4-cyclopropyloxy-2,3-difluorobenzene (PubChem CID 147615512) has the molecular formula C15H16F2O and a molecular weight of 250.29 g/mol. Its IUPAC name is 1-[(E)-2-cyclobutylethenyl]-4-cyclopropyloxy-2,3-difluorobenzene.

Molecular Properties

Compound Name1-[(E)-2-cyclobutylethenyl]-4-cyclopropyloxy-2,3-difluorobenzene
PubChem CID147615512
Molecular FormulaC15H16F2O
Molecular Weight250.29 g/mol
Exact Mass250.12
IUPAC Name1-[(E)-2-cyclobutylethenyl]-4-cyclopropyloxy-2,3-difluorobenzene
SMILESFc1c(/C=C/C2CCC2)ccc(OC2CC2)c1F
InChIInChI=1S/C15H16F2O/c16-14-11(5-4-10-2-1-3-10)6-9-13(15(14)17)18-12-7-8-12/h4-6,9-10,12H,1-3,7-8H2/b5-4+
InChIKeyGCVPVQGZWQOSFN-SNAWJCMRSA-N
XLogP4.32
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.29
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-[(E)-2-cyclobutylethenyl]-4-cyclopropyloxy-2,3-difluorobenzene 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

1-[(E)-2-cyclopropylethenyl]-4-cyclopropyloxy-2,3-difluorobenzene
CID 152846017
1-(cyclobutylmethoxy)-4-[(E)-4-cyclopentylbut-3-enyl]-2,3-difluorobenzene;1-(cyclobutylmethoxy)-4-[(E)-2-cyclopentylethenyl]-2,3-difluorobenzene;1-(cyclobutylmethoxy)-4-[(E)-3-cyclopentylprop-2-enyl]-2,3-difluorobenzene;1-cyclobutyloxy-4-[(E)-4-cyclopentylbut-3-enyl]-2,3-difluorobenzene;1-cyclobutyloxy-4-[(E)-2-cyclopentylethenyl]-2,3-difluorobenzene;1-cyclobutyloxy-4-[(E)-3-cyclopentylprop-2-enyl]-2,3-difluorobenzene;1-[(E)-4-cyclopentylbut-3-enyl]-4-(2-cyclopropylethoxy)-2,3-difluorobenzene;1-[(E)-2-cyclopentylethenyl]-4-(2-cyclopropylethoxy)-2,3-difluorobenzene;1-[(E)-3-cyclopentylprop-2-enyl]-4-(2-cyclopropylethoxy)-2,3-difluorobenzene
CID 161240054
1-[(E)-4-cyclobutylbut-3-enyl]-4-cyclopentyloxy-2,3-difluorobenzene
CID 147649188
1-cyclobutyloxy-4-[(E)-3-cyclobutylprop-2-enoxy]-2-fluoro-3-methylbenzene
CID 158095086
1-cyclobutyloxy-2,3,4-trifluorobenzene
CID 155030976
1-cyclobutyloxy-4-cyclopropyloxy-2-fluoro-3-methylbenzene
CID 158177850
1-cyclopentyl-4-cyclopropyloxy-2,3-difluorobenzene
CID 153282573
1-[4-[(E)-2-(2,3-difluoro-4-prop-2-enoxyphenyl)ethenyl]cyclohexyl]-4-(4-ethoxycyclohexyl)-2,3-difluorobenzene
CID 89430040
1-butoxy-4-[4-[(E)-2-[4-(4-butoxycyclohexyl)-2,3-difluorophenyl]ethenyl]cyclohexyl]-2,3-difluorobenzene
CID 89429620
1-ethenyl-4-[(E)-2-[4-(4-ethoxy-2,3-difluorophenyl)cyclohexyl]ethenyl]-2,3-difluorobenzene
CID 58140557
1-(cyclobutylmethoxy)-4-cyclopropyloxy-2,3-difluorobenzene
CID 153282322
1-cyclobutyloxy-4-cyclopentyl-2,3-difluorobenzene
CID 153282478

Frequently Asked Questions

What is the IUPAC name of 1-[(E)-2-cyclobutylethenyl]-4-cyclopropyloxy-2,3-difluorobenzene?
The IUPAC name of 1-[(E)-2-cyclobutylethenyl]-4-cyclopropyloxy-2,3-difluorobenzene (CID 147615512) is 1-[(E)-2-cyclobutylethenyl]-4-cyclopropyloxy-2,3-difluorobenzene.
What is the SMILES notation for 1-[(E)-2-cyclobutylethenyl]-4-cyclopropyloxy-2,3-difluorobenzene?
The canonical SMILES for 1-[(E)-2-cyclobutylethenyl]-4-cyclopropyloxy-2,3-difluorobenzene is Fc1c(/C=C/C2CCC2)ccc(OC2CC2)c1F.
What is the InChIKey of 1-[(E)-2-cyclobutylethenyl]-4-cyclopropyloxy-2,3-difluorobenzene?
The InChIKey is GCVPVQGZWQOSFN-SNAWJCMRSA-N. The full InChI is InChI=1S/C15H16F2O/c16-14-11(5-4-10-2-1-3-10)6-9-13(15(14)17)18-12-7-8-12/h4-6,9-10,12H,1-3,7-8H2/b5-4+.
What are the key properties of 1-[(E)-2-cyclobutylethenyl]-4-cyclopropyloxy-2,3-difluorobenzene?
1-[(E)-2-cyclobutylethenyl]-4-cyclopropyloxy-2,3-difluorobenzene has a molecular weight of 250.29 g/mol, XLogP of 4.32, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(E)-2-cyclobutylethenyl]-4-cyclopropyloxy-2,3-difluorobenzene is sourced from PubChem (CID 147615512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).