[5-(cyclopropylmethoxy)-3-fluoro-2-pyridinyl]methanol

C10H12FNO2 — CID 58047152

IUPAC[5-(cyclopropylmethoxy)-3-fluoro-2-pyridinyl]methanol
SMILESOCc1ncc(OCC2CC2)cc1F
InChIInChI=1S/C10H12FNO2/c11-9-3-8(4-12-10(9)5-13)14-6-7-1-2-7/h3-4,7,13H,1-2,5-6H2
InChIKeyCQLMAIWNIRXPIM-UHFFFAOYSA-N
MW197.21 g/mol
LogP1.50
Rot. Bonds4

About [5-(cyclopropylmethoxy)-3-fluoro-2-pyridinyl]methanol

[5-(cyclopropylmethoxy)-3-fluoro-2-pyridinyl]methanol (PubChem CID 58047152) has the molecular formula C10H12FNO2 and a molecular weight of 197.21 g/mol. Its IUPAC name is [5-(cyclopropylmethoxy)-3-fluoro-2-pyridinyl]methanol.

Molecular Properties

Compound Name[5-(cyclopropylmethoxy)-3-fluoro-2-pyridinyl]methanol
PubChem CID58047152
Molecular FormulaC10H12FNO2
Molecular Weight197.21 g/mol
Exact Mass197.09
IUPAC Name[5-(cyclopropylmethoxy)-3-fluoro-2-pyridinyl]methanol
SMILESOCc1ncc(OCC2CC2)cc1F
InChIInChI=1S/C10H12FNO2/c11-9-3-8(4-12-10(9)5-13)14-6-7-1-2-7/h3-4,7,13H,1-2,5-6H2
InChIKeyCQLMAIWNIRXPIM-UHFFFAOYSA-N
XLogP1.50
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.21
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [5-(cyclopropylmethoxy)-3-fluoro-2-pyridinyl]methanol?
The IUPAC name of [5-(cyclopropylmethoxy)-3-fluoro-2-pyridinyl]methanol (CID 58047152) is [5-(cyclopropylmethoxy)-3-fluoro-2-pyridinyl]methanol.
What is the SMILES notation for [5-(cyclopropylmethoxy)-3-fluoro-2-pyridinyl]methanol?
The canonical SMILES for [5-(cyclopropylmethoxy)-3-fluoro-2-pyridinyl]methanol is OCc1ncc(OCC2CC2)cc1F.
What is the InChIKey of [5-(cyclopropylmethoxy)-3-fluoro-2-pyridinyl]methanol?
The InChIKey is CQLMAIWNIRXPIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FNO2/c11-9-3-8(4-12-10(9)5-13)14-6-7-1-2-7/h3-4,7,13H,1-2,5-6H2.
What are the key properties of [5-(cyclopropylmethoxy)-3-fluoro-2-pyridinyl]methanol?
[5-(cyclopropylmethoxy)-3-fluoro-2-pyridinyl]methanol has a molecular weight of 197.21 g/mol, XLogP of 1.50, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(cyclopropylmethoxy)-3-fluoro-2-pyridinyl]methanol is sourced from PubChem (CID 58047152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).