1-cyclopentyl-4-cyclopropyloxy-2,3-difluorobenzene

C14H16F2O — CID 153282573

IUPAC1-cyclopentyl-4-cyclopropyloxy-2,3-difluorobenzene
SMILESFc1c(OC2CC2)ccc(C2CCCC2)c1F
InChIInChI=1S/C14H16F2O/c15-13-11(9-3-1-2-4-9)7-8-12(14(13)16)17-10-5-6-10/h7-10H,1-6H2
InChIKeyLSHUJBWMVXSNMH-UHFFFAOYSA-N
MW238.28 g/mol
LogP4.16
Rot. Bonds3

About 1-cyclopentyl-4-cyclopropyloxy-2,3-difluorobenzene

1-cyclopentyl-4-cyclopropyloxy-2,3-difluorobenzene (PubChem CID 153282573) has the molecular formula C14H16F2O and a molecular weight of 238.28 g/mol. Its IUPAC name is 1-cyclopentyl-4-cyclopropyloxy-2,3-difluorobenzene.

Molecular Properties

Compound Name1-cyclopentyl-4-cyclopropyloxy-2,3-difluorobenzene
PubChem CID153282573
Molecular FormulaC14H16F2O
Molecular Weight238.28 g/mol
Exact Mass238.12
IUPAC Name1-cyclopentyl-4-cyclopropyloxy-2,3-difluorobenzene
SMILESFc1c(OC2CC2)ccc(C2CCCC2)c1F
InChIInChI=1S/C14H16F2O/c15-13-11(9-3-1-2-4-9)7-8-12(14(13)16)17-10-5-6-10/h7-10H,1-6H2
InChIKeyLSHUJBWMVXSNMH-UHFFFAOYSA-N
XLogP4.16
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.28
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-cyclobutyloxy-4-cyclopentyl-2,3-difluorobenzene
CID 153282478
1-cyclobutyloxy-2,3,4-trifluorobenzene
CID 155030976
1-cyclohexyl-2,3-difluoro-4-propoxybenzene
CID 90131075
1-cyclobutyloxy-4-cyclopropyloxy-2-fluoro-3-methylbenzene
CID 158177850
1-cyclopentyloxy-2-fluoro-3-methylbenzene
CID 103942608
1-(4-ethylcyclohexyl)-2,3-difluoro-4-(3-propylcyclopentyl)oxybenzene
CID 174722829
4-cyclohexyl-2,3-difluorophenol
CID 134218235
1-(cyclobutylmethoxy)-4-cyclopropyloxy-2,3-difluorobenzene
CID 153282322
1-cyclohexyloxy-2-fluoro-3-methylbenzene
CID 70930096
bis(1-[4-(4-cyclopentylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene);1-cyclopentyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;1-[4-(4-cyclopropylcyclohexyl)cyclohexyl]-2,3-difluoro-4-methylbenzene;1-cyclopropyloxy-2,3-difluoro-4-[4-(4-methylcyclohexyl)cyclohexyl]benzene;bis((2,3-difluoro-4-methylphenyl)-[4-(4-methylcyclohexyl)cyclohexyl]methanol);(2,3-difluoro-4-methylphenyl)-(4-methylcyclohexyl)methanol
CID 163834983
(2S)-3-(4-cyclohexyl-2,3-difluorophenoxy)-2-methylpropan-1-ol
CID 167199971
1-cyclohexyl-4-[4-(2,3-difluoro-4-iodophenyl)cyclohexyl]-2,3-difluorobenzene
CID 90437136

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-4-cyclopropyloxy-2,3-difluorobenzene?
The IUPAC name of 1-cyclopentyl-4-cyclopropyloxy-2,3-difluorobenzene (CID 153282573) is 1-cyclopentyl-4-cyclopropyloxy-2,3-difluorobenzene.
What is the SMILES notation for 1-cyclopentyl-4-cyclopropyloxy-2,3-difluorobenzene?
The canonical SMILES for 1-cyclopentyl-4-cyclopropyloxy-2,3-difluorobenzene is Fc1c(OC2CC2)ccc(C2CCCC2)c1F.
What is the InChIKey of 1-cyclopentyl-4-cyclopropyloxy-2,3-difluorobenzene?
The InChIKey is LSHUJBWMVXSNMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16F2O/c15-13-11(9-3-1-2-4-9)7-8-12(14(13)16)17-10-5-6-10/h7-10H,1-6H2.
What are the key properties of 1-cyclopentyl-4-cyclopropyloxy-2,3-difluorobenzene?
1-cyclopentyl-4-cyclopropyloxy-2,3-difluorobenzene has a molecular weight of 238.28 g/mol, XLogP of 4.16, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-4-cyclopropyloxy-2,3-difluorobenzene is sourced from PubChem (CID 153282573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).