2-(difluoromethyl)-5-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol

C9H12F2N2O — CID 129297105

IUPAC2-(difluoromethyl)-5-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol
SMILESCC1CCn2nc(C(F)F)cc2C1O
InChIInChI=1S/C9H12F2N2O/c1-5-2-3-13-7(8(5)14)4-6(12-13)9(10)11/h4-5,8-9,14H,2-3H2,1H3
InChIKeySPCURTCTCGYCPF-UHFFFAOYSA-N
MW202.20 g/mol
LogP1.89
Rot. Bonds1

About 2-(difluoromethyl)-5-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol

2-(difluoromethyl)-5-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol (PubChem CID 129297105) has the molecular formula C9H12F2N2O and a molecular weight of 202.20 g/mol. Its IUPAC name is 2-(difluoromethyl)-5-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol.

Molecular Properties

Compound Name2-(difluoromethyl)-5-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol
PubChem CID129297105
Molecular FormulaC9H12F2N2O
Molecular Weight202.20 g/mol
Exact Mass202.09
IUPAC Name2-(difluoromethyl)-5-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol
SMILESCC1CCn2nc(C(F)F)cc2C1O
InChIInChI=1S/C9H12F2N2O/c1-5-2-3-13-7(8(5)14)4-6(12-13)9(10)11/h4-5,8-9,14H,2-3H2,1H3
InChIKeySPCURTCTCGYCPF-UHFFFAOYSA-N
XLogP1.89
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.20
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-5-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol?
The IUPAC name of 2-(difluoromethyl)-5-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol (CID 129297105) is 2-(difluoromethyl)-5-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol.
What is the SMILES notation for 2-(difluoromethyl)-5-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol?
The canonical SMILES for 2-(difluoromethyl)-5-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol is CC1CCn2nc(C(F)F)cc2C1O.
What is the InChIKey of 2-(difluoromethyl)-5-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol?
The InChIKey is SPCURTCTCGYCPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12F2N2O/c1-5-2-3-13-7(8(5)14)4-6(12-13)9(10)11/h4-5,8-9,14H,2-3H2,1H3.
What are the key properties of 2-(difluoromethyl)-5-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol?
2-(difluoromethyl)-5-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol has a molecular weight of 202.20 g/mol, XLogP of 1.89, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-5-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-ol is sourced from PubChem (CID 129297105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).