(3-fluoro-2-indazol-1-yl-4-pyridinyl)methanol

C13H10FN3O — CID 105383216

IUPAC(3-fluoro-2-indazol-1-yl-4-pyridinyl)methanol
SMILESOCc1ccnc(-n2ncc3ccccc32)c1F
InChIInChI=1S/C13H10FN3O/c14-12-10(8-18)5-6-15-13(12)17-11-4-2-1-3-9(11)7-16-17/h1-7,18H,8H2
InChIKeySXRBNENRQCOAGL-UHFFFAOYSA-N
MW243.24 g/mol
LogP2.05
Rot. Bonds2

About (3-fluoro-2-indazol-1-yl-4-pyridinyl)methanol

(3-fluoro-2-indazol-1-yl-4-pyridinyl)methanol (PubChem CID 105383216) has the molecular formula C13H10FN3O and a molecular weight of 243.24 g/mol. Its IUPAC name is (3-fluoro-2-indazol-1-yl-4-pyridinyl)methanol.

Molecular Properties

Compound Name(3-fluoro-2-indazol-1-yl-4-pyridinyl)methanol
PubChem CID105383216
Molecular FormulaC13H10FN3O
Molecular Weight243.24 g/mol
Exact Mass243.08
IUPAC Name(3-fluoro-2-indazol-1-yl-4-pyridinyl)methanol
SMILESOCc1ccnc(-n2ncc3ccccc32)c1F
InChIInChI=1S/C13H10FN3O/c14-12-10(8-18)5-6-15-13(12)17-11-4-2-1-3-9(11)7-16-17/h1-7,18H,8H2
InChIKeySXRBNENRQCOAGL-UHFFFAOYSA-N
XLogP2.05
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.24
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(4-[1-(3-Fluoro-benzyl)-1H-indazol-5-ylamino]-pyrrolo[2,1-f][1,2,4]triazin-5-yl}-methanol
CID 22390542
[1-[3-Fluoro-4-[[2-(piperidin-4-ylamino)-1,6-naphthyridin-7-yl]amino]phenyl]pyrazol-3-yl]methanol
CID 156212505
(3-(4-(1H-indazol-4-ylamino)pyrimidin-2-ylamino)phenyl)methanol
CID 52944677
[6-Phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridin-4-yl]methanol
CID 71602073
2-[1-[6-[4-(6-Fluoroindol-1-yl)piperidin-1-yl]pyridazin-3-yl]pyrazol-4-yl]ethanol
CID 71585396
6-(6-Bromo-4-fluoro-1H-indazol-1-yl)-2-pyridinemethanol
CID 118663841
US10246456, Example 244
CID 118664572
[4-[6-[4-(6-Fluoroindol-1-yl)piperidin-1-yl]pyridazin-3-yl]phenyl]methanol
CID 121224989
[1-[6-(Aminomethyl)pyrimidin-4-yl]indazol-4-yl]methanol;hydrochloride
CID 135185949
[2-[1-[(2-Fluorophenyl)methyl]pyrazolo[5,4-b]pyridin-3-yl]pyrimidin-4-yl]methanol
CID 44378697
US10246456, Example 566
CID 118663980
US10246456, Example 404
CID 118664118

Frequently Asked Questions

What is the IUPAC name of (3-fluoro-2-indazol-1-yl-4-pyridinyl)methanol?
The IUPAC name of (3-fluoro-2-indazol-1-yl-4-pyridinyl)methanol (CID 105383216) is (3-fluoro-2-indazol-1-yl-4-pyridinyl)methanol.
What is the SMILES notation for (3-fluoro-2-indazol-1-yl-4-pyridinyl)methanol?
The canonical SMILES for (3-fluoro-2-indazol-1-yl-4-pyridinyl)methanol is OCc1ccnc(-n2ncc3ccccc32)c1F.
What is the InChIKey of (3-fluoro-2-indazol-1-yl-4-pyridinyl)methanol?
The InChIKey is SXRBNENRQCOAGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10FN3O/c14-12-10(8-18)5-6-15-13(12)17-11-4-2-1-3-9(11)7-16-17/h1-7,18H,8H2.
What are the key properties of (3-fluoro-2-indazol-1-yl-4-pyridinyl)methanol?
(3-fluoro-2-indazol-1-yl-4-pyridinyl)methanol has a molecular weight of 243.24 g/mol, XLogP of 2.05, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoro-2-indazol-1-yl-4-pyridinyl)methanol is sourced from PubChem (CID 105383216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).