1-(3-fluoro-2,5-dimethylphenyl)cyclopropan-1-ol

C11H13FO — CID 84768148

IUPAC1-(3-fluoro-2,5-dimethylphenyl)cyclopropan-1-ol
SMILESCc1cc(F)c(C)c(C2(O)CC2)c1
InChIInChI=1S/C11H13FO/c1-7-5-9(11(13)3-4-11)8(2)10(12)6-7/h5-6,13H,3-4H2,1-2H3
InChIKeyZDHYQCISCZZRMI-UHFFFAOYSA-N
MW180.22 g/mol
LogP2.42
Rot. Bonds1

About 1-(3-fluoro-2,5-dimethylphenyl)cyclopropan-1-ol

1-(3-fluoro-2,5-dimethylphenyl)cyclopropan-1-ol (PubChem CID 84768148) has the molecular formula C11H13FO and a molecular weight of 180.22 g/mol. Its IUPAC name is 1-(3-fluoro-2,5-dimethylphenyl)cyclopropan-1-ol.

Molecular Properties

Compound Name1-(3-fluoro-2,5-dimethylphenyl)cyclopropan-1-ol
PubChem CID84768148
Molecular FormulaC11H13FO
Molecular Weight180.22 g/mol
Exact Mass180.10
IUPAC Name1-(3-fluoro-2,5-dimethylphenyl)cyclopropan-1-ol
SMILESCc1cc(F)c(C)c(C2(O)CC2)c1
InChIInChI=1S/C11H13FO/c1-7-5-9(11(13)3-4-11)8(2)10(12)6-7/h5-6,13H,3-4H2,1-2H3
InChIKeyZDHYQCISCZZRMI-UHFFFAOYSA-N
XLogP2.42
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.22
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(3-fluoro-2-methylphenyl)cyclopropan-1-ol
CID 117276386
1-(5-fluoro-3,4-dimethoxy-2-methylphenyl)cyclopropan-1-ol
CID 117325333
1-(2-fluoro-5-methylphenyl)cyclopentan-1-ol
CID 62788885
8-(2-fluoro-5-methylphenyl)spiro[4.5]decan-8-ol
CID 114819243
1-(2,3,4,5-tetramethylphenyl)cyclopropan-1-ol
CID 117282039
CID 144806033
CID 144806033
2-(1-aminocyclobutyl)-6-fluoro-4-methylphenol
CID 117285395
2-(1-aminocyclohexyl)-6-fluoro-4-methylphenol
CID 117320128
1-(2-amino-5-fluoro-4-methylphenyl)cyclopropan-1-ol
CID 168788223
1-(5-chloro-4-fluoro-2-methylphenyl)cyclopropan-1-ol
CID 117289605
1-(5-fluoro-2-methyl-1H-indol-6-yl)cyclopropan-1-ol
CID 117293363
1-(4-fluoro-5-methoxy-2-methylphenyl)cyclopropan-1-ol
CID 84773917

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoro-2,5-dimethylphenyl)cyclopropan-1-ol?
The IUPAC name of 1-(3-fluoro-2,5-dimethylphenyl)cyclopropan-1-ol (CID 84768148) is 1-(3-fluoro-2,5-dimethylphenyl)cyclopropan-1-ol.
What is the SMILES notation for 1-(3-fluoro-2,5-dimethylphenyl)cyclopropan-1-ol?
The canonical SMILES for 1-(3-fluoro-2,5-dimethylphenyl)cyclopropan-1-ol is Cc1cc(F)c(C)c(C2(O)CC2)c1.
What is the InChIKey of 1-(3-fluoro-2,5-dimethylphenyl)cyclopropan-1-ol?
The InChIKey is ZDHYQCISCZZRMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FO/c1-7-5-9(11(13)3-4-11)8(2)10(12)6-7/h5-6,13H,3-4H2,1-2H3.
What are the key properties of 1-(3-fluoro-2,5-dimethylphenyl)cyclopropan-1-ol?
1-(3-fluoro-2,5-dimethylphenyl)cyclopropan-1-ol has a molecular weight of 180.22 g/mol, XLogP of 2.42, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoro-2,5-dimethylphenyl)cyclopropan-1-ol is sourced from PubChem (CID 84768148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).