3-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)propan-1-ol

C16H17N3O — CID 44577861

IUPAC3-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)propan-1-ol
SMILESCc1nn(-c2ccccc2)c2ncc(CCCO)cc12
InChIInChI=1S/C16H17N3O/c1-12-15-10-13(6-5-9-20)11-17-16(15)19(18-12)14-7-3-2-4-8-14/h2-4,7-8,10-11,20H,5-6,9H2,1H3
InChIKeyQAVORYAMICRPPM-UHFFFAOYSA-N
MW267.33 g/mol
LogP2.65
Rot. Bonds4

About 3-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)propan-1-ol

3-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)propan-1-ol (PubChem CID 44577861) has the molecular formula C16H17N3O and a molecular weight of 267.33 g/mol. Its IUPAC name is 3-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)propan-1-ol.

Molecular Properties

Compound Name3-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)propan-1-ol
PubChem CID44577861
Molecular FormulaC16H17N3O
Molecular Weight267.33 g/mol
Exact Mass267.14
IUPAC Name3-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)propan-1-ol
SMILESCc1nn(-c2ccccc2)c2ncc(CCCO)cc12
InChIInChI=1S/C16H17N3O/c1-12-15-10-13(6-5-9-20)11-17-16(15)19(18-12)14-7-3-2-4-8-14/h2-4,7-8,10-11,20H,5-6,9H2,1H3
InChIKeyQAVORYAMICRPPM-UHFFFAOYSA-N
XLogP2.65
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)propan-1-ol?
The IUPAC name of 3-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)propan-1-ol (CID 44577861) is 3-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)propan-1-ol.
What is the SMILES notation for 3-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)propan-1-ol?
The canonical SMILES for 3-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)propan-1-ol is Cc1nn(-c2ccccc2)c2ncc(CCCO)cc12.
What is the InChIKey of 3-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)propan-1-ol?
The InChIKey is QAVORYAMICRPPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O/c1-12-15-10-13(6-5-9-20)11-17-16(15)19(18-12)14-7-3-2-4-8-14/h2-4,7-8,10-11,20H,5-6,9H2,1H3.
What are the key properties of 3-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)propan-1-ol?
3-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)propan-1-ol has a molecular weight of 267.33 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methyl-1-phenylpyrazolo[5,4-b]pyridin-5-yl)propan-1-ol is sourced from PubChem (CID 44577861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).