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

C12H13N3O2 — CID 121389456

IUPAC8-(1-methylpyrazol-4-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol
SMILESCn1cc(-c2cncc3c2COCC3O)cn1
InChIInChI=1S/C12H13N3O2/c1-15-5-8(2-14-15)9-3-13-4-10-11(9)6-17-7-12(10)16/h2-5,12,16H,6-7H2,1H3
InChIKeyAYVDUUPAIVNSLY-UHFFFAOYSA-N
MW231.25 g/mol
LogP1.05
Rot. Bonds1

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

8-(1-methylpyrazol-4-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol (PubChem CID 121389456) has the molecular formula C12H13N3O2 and a molecular weight of 231.25 g/mol. Its IUPAC name is 8-(1-methylpyrazol-4-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol.

Molecular Properties

Compound Name8-(1-methylpyrazol-4-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol
PubChem CID121389456
Molecular FormulaC12H13N3O2
Molecular Weight231.25 g/mol
Exact Mass231.10
IUPAC Name8-(1-methylpyrazol-4-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol
SMILESCn1cc(-c2cncc3c2COCC3O)cn1
InChIInChI=1S/C12H13N3O2/c1-15-5-8(2-14-15)9-3-13-4-10-11(9)6-17-7-12(10)16/h2-5,12,16H,6-7H2,1H3
InChIKeyAYVDUUPAIVNSLY-UHFFFAOYSA-N
XLogP1.05
TPSA60.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.25
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 8-(1-methylpyrazol-4-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol with MolForge

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Related Compounds

6-(4-hydroxy-3,4-dihydro-1H-pyrano[4,3-c]pyridin-8-yl)-2-methyl-3,4-dihydroisoquinolin-1-one
CID 121389340
N-[8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-yl]propanamide
CID 121389390
4-bromo-5-(1-methylpyrazol-4-yl)pyrimidine
CID 105370998
5-(1-methylpyrazol-4-yl)-1H-pyrimidine-6-thione
CID 106515837
(NE)-N-[1-[5-(1-methylpyrazol-4-yl)-3-pyridinyl]ethylidene]hydroxylamine
CID 82534296
8-(4-ethenyl-3-methylphenyl)-4-methyl-3,4-dihydro-1H-pyrano[4,3-c]pyridine
CID 145094819
1-methyl-4-(4-phenylphenyl)pyrazole
CID 135064285
[2-(1-methylpyrazol-4-yl)phenyl]phosphane
CID 166648081
5-ethyl-6-(1-methylpyrazol-4-yl)-4,5-dihydropyridazin-3-amine
CID 64691566
(1-methylpyrazol-4-yl)-(3-oxabicyclo[3.1.0]hexan-6-yl)methanone
CID 130763997
8-(3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)spiro[1,4-dihydropyrano[4,3-c]pyridine-3,1'-cyclopropane]-4-ol
CID 121389413
5-[3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-5-yl]furan-3-carboxylic acid
CID 154690729

Frequently Asked Questions

What is the IUPAC name of 8-(1-methylpyrazol-4-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol?
The IUPAC name of 8-(1-methylpyrazol-4-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol (CID 121389456) is 8-(1-methylpyrazol-4-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol.
What is the SMILES notation for 8-(1-methylpyrazol-4-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol?
The canonical SMILES for 8-(1-methylpyrazol-4-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol is Cn1cc(-c2cncc3c2COCC3O)cn1.
What is the InChIKey of 8-(1-methylpyrazol-4-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol?
The InChIKey is AYVDUUPAIVNSLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O2/c1-15-5-8(2-14-15)9-3-13-4-10-11(9)6-17-7-12(10)16/h2-5,12,16H,6-7H2,1H3.
What are the key properties of 8-(1-methylpyrazol-4-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol?
8-(1-methylpyrazol-4-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol has a molecular weight of 231.25 g/mol, XLogP of 1.05, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(1-methylpyrazol-4-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol is sourced from PubChem (CID 121389456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).