4-(cyclopropylmethoxy)-2-(difluoromethoxy)-1-fluorobenzene

C11H11F3O2 — CID 141339892

IUPAC4-(cyclopropylmethoxy)-2-(difluoromethoxy)-1-fluorobenzene
SMILESFc1ccc(OCC2CC2)cc1OC(F)F
InChIInChI=1S/C11H11F3O2/c12-9-4-3-8(15-6-7-1-2-7)5-10(9)16-11(13)14/h3-5,7,11H,1-2,6H2
InChIKeyGDZQGDAAERSRTJ-UHFFFAOYSA-N
MW232.20 g/mol
LogP3.22
Rot. Bonds5

About 4-(cyclopropylmethoxy)-2-(difluoromethoxy)-1-fluorobenzene

4-(cyclopropylmethoxy)-2-(difluoromethoxy)-1-fluorobenzene (PubChem CID 141339892) has the molecular formula C11H11F3O2 and a molecular weight of 232.20 g/mol. Its IUPAC name is 4-(cyclopropylmethoxy)-2-(difluoromethoxy)-1-fluorobenzene.

Molecular Properties

Compound Name4-(cyclopropylmethoxy)-2-(difluoromethoxy)-1-fluorobenzene
PubChem CID141339892
Molecular FormulaC11H11F3O2
Molecular Weight232.20 g/mol
Exact Mass232.07
IUPAC Name4-(cyclopropylmethoxy)-2-(difluoromethoxy)-1-fluorobenzene
SMILESFc1ccc(OCC2CC2)cc1OC(F)F
InChIInChI=1S/C11H11F3O2/c12-9-4-3-8(15-6-7-1-2-7)5-10(9)16-11(13)14/h3-5,7,11H,1-2,6H2
InChIKeyGDZQGDAAERSRTJ-UHFFFAOYSA-N
XLogP3.22
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.20
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-(cyclopropylmethoxy)-2-(difluoromethoxy)-1-fluorobenzene 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-chloro-4-(cyclopropylmethoxy)-1-fluorobenzene
CID 130693986
1-(cyclopropylmethoxy)-2-(difluoromethoxy)benzene
CID 54215709
[4-[(3,4-difluorophenoxy)methyl]cyclohexyl]methanol
CID 139623977
(1S)-1-[5-(cyclopropylmethoxy)-2-fluorophenyl]ethanamine;molecular hydrogen
CID 142361370
4-[(3,4-difluorophenoxy)methyl]piperidine
CID 17178047
2-(cyclohexylmethoxy)-4-(difluoromethoxy)-5-fluoroaniline
CID 63594077
4-(cyclopropylmethoxy)-1-fluoro-2-propylbenzene;propane
CID 142580919
1-[4-(cyclopropylmethoxy)-2-fluorophenyl]ethanamine
CID 107715743
2-(cyclopropylmethoxy)-1-fluoro-4-iodobenzene
CID 131315534
4-(difluoromethoxy)-5-fluoro-2-(oxan-4-ylmethoxy)aniline
CID 63594226
4-(cyclopropylmethoxy)-3-(difluoromethoxy)benzaldehyde
CID 19705426
(1S)-1-[3-(cyclopropylmethoxy)-4-fluorophenyl]-N,2-dimethylpropan-1-amine
CID 142399901

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopropylmethoxy)-2-(difluoromethoxy)-1-fluorobenzene?
The IUPAC name of 4-(cyclopropylmethoxy)-2-(difluoromethoxy)-1-fluorobenzene (CID 141339892) is 4-(cyclopropylmethoxy)-2-(difluoromethoxy)-1-fluorobenzene.
What is the SMILES notation for 4-(cyclopropylmethoxy)-2-(difluoromethoxy)-1-fluorobenzene?
The canonical SMILES for 4-(cyclopropylmethoxy)-2-(difluoromethoxy)-1-fluorobenzene is Fc1ccc(OCC2CC2)cc1OC(F)F.
What is the InChIKey of 4-(cyclopropylmethoxy)-2-(difluoromethoxy)-1-fluorobenzene?
The InChIKey is GDZQGDAAERSRTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F3O2/c12-9-4-3-8(15-6-7-1-2-7)5-10(9)16-11(13)14/h3-5,7,11H,1-2,6H2.
What are the key properties of 4-(cyclopropylmethoxy)-2-(difluoromethoxy)-1-fluorobenzene?
4-(cyclopropylmethoxy)-2-(difluoromethoxy)-1-fluorobenzene has a molecular weight of 232.20 g/mol, XLogP of 3.22, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopropylmethoxy)-2-(difluoromethoxy)-1-fluorobenzene is sourced from PubChem (CID 141339892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).