8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol

C16H15N3O2 — CID 121389372

IUPAC8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol
SMILESCn1ncc2ccc(-c3cncc4c3COCC4O)cc21
InChIInChI=1S/C16H15N3O2/c1-19-15-4-10(2-3-11(15)5-18-19)12-6-17-7-13-14(12)8-21-9-16(13)20/h2-7,16,20H,8-9H2,1H3
InChIKeyALKNXOXFUDVNSW-UHFFFAOYSA-N
MW281.31 g/mol
LogP2.20
Rot. Bonds1

About 8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol

8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol (PubChem CID 121389372) has the molecular formula C16H15N3O2 and a molecular weight of 281.31 g/mol. Its IUPAC name is 8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol.

Molecular Properties

Compound Name8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol
PubChem CID121389372
Molecular FormulaC16H15N3O2
Molecular Weight281.31 g/mol
Exact Mass281.12
IUPAC Name8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol
SMILESCn1ncc2ccc(-c3cncc4c3COCC4O)cc21
InChIInChI=1S/C16H15N3O2/c1-19-15-4-10(2-3-11(15)5-18-19)12-6-17-7-13-14(12)8-21-9-16(13)20/h2-7,16,20H,8-9H2,1H3
InChIKeyALKNXOXFUDVNSW-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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Frequently Asked Questions

What is the IUPAC name of 8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol?
The IUPAC name of 8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol (CID 121389372) is 8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol.
What is the SMILES notation for 8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol?
The canonical SMILES for 8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol is Cn1ncc2ccc(-c3cncc4c3COCC4O)cc21.
What is the InChIKey of 8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol?
The InChIKey is ALKNXOXFUDVNSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2/c1-19-15-4-10(2-3-11(15)5-18-19)12-6-17-7-13-14(12)8-21-9-16(13)20/h2-7,16,20H,8-9H2,1H3.
What are the key properties of 8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol?
8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-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 8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol is sourced from PubChem (CID 121389372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).