1-(cyclobutylidenemethyl)-3-(cyclopropylmethoxy)-5-fluorobenzene

C15H17FO — CID 142360754

IUPAC1-(cyclobutylidenemethyl)-3-(cyclopropylmethoxy)-5-fluorobenzene
SMILESFc1cc(C=C2CCC2)cc(OCC2CC2)c1
InChIInChI=1S/C15H17FO/c16-14-7-13(6-11-2-1-3-11)8-15(9-14)17-10-12-4-5-12/h6-9,12H,1-5,10H2
InChIKeyUGRCTKZTTOMCOD-UHFFFAOYSA-N
MW232.30 g/mol
LogP4.18
Rot. Bonds4

About 1-(cyclobutylidenemethyl)-3-(cyclopropylmethoxy)-5-fluorobenzene

1-(cyclobutylidenemethyl)-3-(cyclopropylmethoxy)-5-fluorobenzene (PubChem CID 142360754) has the molecular formula C15H17FO and a molecular weight of 232.30 g/mol. Its IUPAC name is 1-(cyclobutylidenemethyl)-3-(cyclopropylmethoxy)-5-fluorobenzene.

Molecular Properties

Compound Name1-(cyclobutylidenemethyl)-3-(cyclopropylmethoxy)-5-fluorobenzene
PubChem CID142360754
Molecular FormulaC15H17FO
Molecular Weight232.30 g/mol
Exact Mass232.13
IUPAC Name1-(cyclobutylidenemethyl)-3-(cyclopropylmethoxy)-5-fluorobenzene
SMILESFc1cc(C=C2CCC2)cc(OCC2CC2)c1
InChIInChI=1S/C15H17FO/c16-14-7-13(6-11-2-1-3-11)8-15(9-14)17-10-12-4-5-12/h6-9,12H,1-5,10H2
InChIKeyUGRCTKZTTOMCOD-UHFFFAOYSA-N
XLogP4.18
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.30
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-(cyclopropylmethoxy)-5-fluoroaniline
CID 80751840
3-(cyclopropylmethoxymethoxy)-5-fluorobenzaldehyde
CID 106929635
[3-(cyclopropylmethoxy)-5-fluorophenyl]boronic acid
CID 81332154
1-(cyclopropylmethoxy)-3-fluoro-5-nitrobenzene
CID 80752883
3-(2-cyclobutylethoxy)-5-fluorobenzaldehyde
CID 106202440
1-[3-(cyclobutylmethoxy)-5-fluorophenyl]ethanone
CID 84687564
3-fluoro-5-[[4-(trifluoromethyl)cyclohexyl]methoxy]phenol
CID 146557307
(1S)-1-[3-(cyclopropylmethoxy)-5-fluorophenyl]-N-methylethanamine
CID 135220431
1-[3-(cyclobutylmethoxy)-5-fluorophenyl]-2-methylpropan-2-amine
CID 117382059
1-(cyclohexylmethoxy)-3-fluorobenzene
CID 60731171
1-(3-chloroprop-1-ynyl)-3-(cyclobutylmethoxy)-5-fluorobenzene
CID 81326207
3-[3-(cyclopentylmethoxy)-5-fluorophenyl]prop-2-yn-1-amine
CID 81326455

Frequently Asked Questions

What is the IUPAC name of 1-(cyclobutylidenemethyl)-3-(cyclopropylmethoxy)-5-fluorobenzene?
The IUPAC name of 1-(cyclobutylidenemethyl)-3-(cyclopropylmethoxy)-5-fluorobenzene (CID 142360754) is 1-(cyclobutylidenemethyl)-3-(cyclopropylmethoxy)-5-fluorobenzene.
What is the SMILES notation for 1-(cyclobutylidenemethyl)-3-(cyclopropylmethoxy)-5-fluorobenzene?
The canonical SMILES for 1-(cyclobutylidenemethyl)-3-(cyclopropylmethoxy)-5-fluorobenzene is Fc1cc(C=C2CCC2)cc(OCC2CC2)c1.
What is the InChIKey of 1-(cyclobutylidenemethyl)-3-(cyclopropylmethoxy)-5-fluorobenzene?
The InChIKey is UGRCTKZTTOMCOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FO/c16-14-7-13(6-11-2-1-3-11)8-15(9-14)17-10-12-4-5-12/h6-9,12H,1-5,10H2.
What are the key properties of 1-(cyclobutylidenemethyl)-3-(cyclopropylmethoxy)-5-fluorobenzene?
1-(cyclobutylidenemethyl)-3-(cyclopropylmethoxy)-5-fluorobenzene has a molecular weight of 232.30 g/mol, XLogP of 4.18, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclobutylidenemethyl)-3-(cyclopropylmethoxy)-5-fluorobenzene is sourced from PubChem (CID 142360754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).