1-(3-fluoro-5-propan-2-yl-2-pyridinyl)cyclopropan-1-ol

C11H14FNO — CID 176651302

IUPAC1-(3-fluoro-5-propan-2-yl-2-pyridinyl)cyclopropan-1-ol
SMILESCC(C)c1cnc(C2(O)CC2)c(F)c1
InChIInChI=1S/C11H14FNO/c1-7(2)8-5-9(12)10(13-6-8)11(14)3-4-11/h5-7,14H,3-4H2,1-2H3
InChIKeyUHPVXQCWBCBUMY-UHFFFAOYSA-N
MW195.24 g/mol
LogP2.33
Rot. Bonds2

About 1-(3-fluoro-5-propan-2-yl-2-pyridinyl)cyclopropan-1-ol

1-(3-fluoro-5-propan-2-yl-2-pyridinyl)cyclopropan-1-ol (PubChem CID 176651302) has the molecular formula C11H14FNO and a molecular weight of 195.24 g/mol. Its IUPAC name is 1-(3-fluoro-5-propan-2-yl-2-pyridinyl)cyclopropan-1-ol.

Molecular Properties

Compound Name1-(3-fluoro-5-propan-2-yl-2-pyridinyl)cyclopropan-1-ol
PubChem CID176651302
Molecular FormulaC11H14FNO
Molecular Weight195.24 g/mol
Exact Mass195.11
IUPAC Name1-(3-fluoro-5-propan-2-yl-2-pyridinyl)cyclopropan-1-ol
SMILESCC(C)c1cnc(C2(O)CC2)c(F)c1
InChIInChI=1S/C11H14FNO/c1-7(2)8-5-9(12)10(13-6-8)11(14)3-4-11/h5-7,14H,3-4H2,1-2H3
InChIKeyUHPVXQCWBCBUMY-UHFFFAOYSA-N
XLogP2.33
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoro-5-propan-2-yl-2-pyridinyl)cyclopropan-1-ol?
The IUPAC name of 1-(3-fluoro-5-propan-2-yl-2-pyridinyl)cyclopropan-1-ol (CID 176651302) is 1-(3-fluoro-5-propan-2-yl-2-pyridinyl)cyclopropan-1-ol.
What is the SMILES notation for 1-(3-fluoro-5-propan-2-yl-2-pyridinyl)cyclopropan-1-ol?
The canonical SMILES for 1-(3-fluoro-5-propan-2-yl-2-pyridinyl)cyclopropan-1-ol is CC(C)c1cnc(C2(O)CC2)c(F)c1.
What is the InChIKey of 1-(3-fluoro-5-propan-2-yl-2-pyridinyl)cyclopropan-1-ol?
The InChIKey is UHPVXQCWBCBUMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO/c1-7(2)8-5-9(12)10(13-6-8)11(14)3-4-11/h5-7,14H,3-4H2,1-2H3.
What are the key properties of 1-(3-fluoro-5-propan-2-yl-2-pyridinyl)cyclopropan-1-ol?
1-(3-fluoro-5-propan-2-yl-2-pyridinyl)cyclopropan-1-ol has a molecular weight of 195.24 g/mol, XLogP of 2.33, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoro-5-propan-2-yl-2-pyridinyl)cyclopropan-1-ol is sourced from PubChem (CID 176651302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).