5-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridin-4-ol

C16H15N3O2 — CID 121389398

IUPAC5-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridin-4-ol
SMILESCn1ncc2ccc(-c3cncc4c3C(O)COC4)cc21
InChIInChI=1S/C16H15N3O2/c1-19-14-4-10(2-3-11(14)6-18-19)13-7-17-5-12-8-21-9-15(20)16(12)13/h2-7,15,20H,8-9H2,1H3
InChIKeyDGYFQPOBIHORSK-UHFFFAOYSA-N
MW281.31 g/mol
LogP2.20
Rot. Bonds1

About 5-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridin-4-ol

5-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridin-4-ol (PubChem CID 121389398) has the molecular formula C16H15N3O2 and a molecular weight of 281.31 g/mol. Its IUPAC name is 5-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridin-4-ol.

Molecular Properties

Compound Name5-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridin-4-ol
PubChem CID121389398
Molecular FormulaC16H15N3O2
Molecular Weight281.31 g/mol
Exact Mass281.12
IUPAC Name5-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridin-4-ol
SMILESCn1ncc2ccc(-c3cncc4c3C(O)COC4)cc21
InChIInChI=1S/C16H15N3O2/c1-19-14-4-10(2-3-11(14)6-18-19)13-7-17-5-12-8-21-9-15(20)16(12)13/h2-7,15,20H,8-9H2,1H3
InChIKeyDGYFQPOBIHORSK-UHFFFAOYSA-N
XLogP2.20
TPSA60.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2S,3R,4S,5R)-2-[1-[(4-propylphenyl)methyl]indol-3-yl]oxane-3,4,5-triol
CID 70690752
8-(4-Fluoro-1-methyl-1H-indazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ylamine, Enantiomer II
CID 121379068
8-(3-Fluoro-1-methyl-1H-indazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol, Enantiomer II
CID 121379081
8-(4-Fluoro-1-methyl-1H-indazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol, Enantiomer II
CID 121379083
8-(5-Fluoro-1-methyl-1H-indazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol, Enantiomer II
CID 121389328
8-(3-Fluoro-1-methyl-1H-indazol-6-yl)-4-methyl-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol, Enantiomer I
CID 121389402
8-(2-Methyl-5-trifluoromethyl-2H-pyrazol-3-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol, Enantiomer II
CID 121389408
8-(4-fluoro-1-methyl-indazol-6-yl)spiro[1,4-dihydropyrano[4,3-c]pyridine-3,1''-cyclopropane]-4-ol, Enantiomer II
CID 121389412
8-(4-Fluoro-1-methyl-1H-indazol-6-yl)-4-methyl-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol, Enantiomer II
CID 121389420
Dimethyl-[8-(1-methyl-1H-indazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-yl]-amine, Enantiomer II
CID 121379061
8-(1-Methyl-4,5,6,7-tetrahydro-1H-indazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol, Diastereomer I
CID 121379070
8-(1-Methyl-1H-indazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ylamine, Enantiomer II
CID 121379072

Frequently Asked Questions

What is the IUPAC name of 5-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridin-4-ol?
The IUPAC name of 5-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridin-4-ol (CID 121389398) is 5-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridin-4-ol.
What is the SMILES notation for 5-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridin-4-ol?
The canonical SMILES for 5-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridin-4-ol is Cn1ncc2ccc(-c3cncc4c3C(O)COC4)cc21.
What is the InChIKey of 5-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridin-4-ol?
The InChIKey is DGYFQPOBIHORSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2/c1-19-14-4-10(2-3-11(14)6-18-19)13-7-17-5-12-8-21-9-15(20)16(12)13/h2-7,15,20H,8-9H2,1H3.
What are the key properties of 5-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridin-4-ol?
5-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridin-4-ol has a molecular weight of 281.31 g/mol, XLogP of 2.20, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridin-4-ol is sourced from PubChem (CID 121389398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).