(4-cyclopropyl-3-fluorophenyl)methanol;ethane

C12H17FO — CID 144930453

IUPAC(4-cyclopropyl-3-fluorophenyl)methanol;ethane
SMILESCC.OCc1ccc(C2CC2)c(F)c1
InChIInChI=1S/C10H11FO.C2H6/c11-10-5-7(6-12)1-4-9(10)8-2-3-8;1-2/h1,4-5,8,12H,2-3,6H2;1-2H3
InChIKeyGDOLXYAKCPGUHQ-UHFFFAOYSA-N
MW196.26 g/mol
LogP3.22
Rot. Bonds2

About (4-cyclopropyl-3-fluorophenyl)methanol;ethane

(4-cyclopropyl-3-fluorophenyl)methanol;ethane (PubChem CID 144930453) has the molecular formula C12H17FO and a molecular weight of 196.26 g/mol. Its IUPAC name is (4-cyclopropyl-3-fluorophenyl)methanol;ethane.

Molecular Properties

Compound Name(4-cyclopropyl-3-fluorophenyl)methanol;ethane
PubChem CID144930453
Molecular FormulaC12H17FO
Molecular Weight196.26 g/mol
Exact Mass196.13
IUPAC Name(4-cyclopropyl-3-fluorophenyl)methanol;ethane
SMILESCC.OCc1ccc(C2CC2)c(F)c1
InChIInChI=1S/C10H11FO.C2H6/c11-10-5-7(6-12)1-4-9(10)8-2-3-8;1-2/h1,4-5,8,12H,2-3,6H2;1-2H3
InChIKeyGDOLXYAKCPGUHQ-UHFFFAOYSA-N
XLogP3.22
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.26
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-cyclopropyl-2-fluoro-4-methylbenzene;ethane
CID 144800459
1-[(4-cyclopropyl-3-fluorophenyl)methyl]cyclopropan-1-amine
CID 117293738
3-(4-cyclohexyl-3-fluorophenyl)propan-1-ol
CID 117345509
4-(4-ethyl-2-fluorophenyl)oxane
CID 149055517
4-cyclopropyl-3-fluorophenol
CID 83131228
N-[(4-cyclohexyl-3-fluorophenyl)methyl]hydroxylamine
CID 117320222
(3,4-difluorophenyl)methanol
CID 522833
[4-(4,4-dimethyl-1,3-oxazolidin-2-yl)-3-fluorophenyl]methanol
CID 23437091
1-(4-ethenylcyclohexyl)-2-fluoro-4-propylbenzene
CID 71422815
4-(2-fluoro-4-propylphenyl)oxane
CID 153081672
2-cyclopropyl-4-(hydroxymethyl)benzonitrile
CID 118268979
(3-cyclopropylphenyl)methanol;ethane;molecular hydrogen
CID 156722104

Frequently Asked Questions

What is the IUPAC name of (4-cyclopropyl-3-fluorophenyl)methanol;ethane?
The IUPAC name of (4-cyclopropyl-3-fluorophenyl)methanol;ethane (CID 144930453) is (4-cyclopropyl-3-fluorophenyl)methanol;ethane.
What is the SMILES notation for (4-cyclopropyl-3-fluorophenyl)methanol;ethane?
The canonical SMILES for (4-cyclopropyl-3-fluorophenyl)methanol;ethane is CC.OCc1ccc(C2CC2)c(F)c1.
What is the InChIKey of (4-cyclopropyl-3-fluorophenyl)methanol;ethane?
The InChIKey is GDOLXYAKCPGUHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FO.C2H6/c11-10-5-7(6-12)1-4-9(10)8-2-3-8;1-2/h1,4-5,8,12H,2-3,6H2;1-2H3.
What are the key properties of (4-cyclopropyl-3-fluorophenyl)methanol;ethane?
(4-cyclopropyl-3-fluorophenyl)methanol;ethane has a molecular weight of 196.26 g/mol, XLogP of 3.22, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclopropyl-3-fluorophenyl)methanol;ethane is sourced from PubChem (CID 144930453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).