3,5-diphenyl-1H-pyrazolo[4,3-b]pyridine;ethane

C22H25N3 — CID 160775016

IUPAC3,5-diphenyl-1H-pyrazolo[4,3-b]pyridine;ethane
SMILESCC.CC.c1ccc(-c2ccc3[nH]nc(-c4ccccc4)c3n2)cc1
InChIInChI=1S/C18H13N3.2C2H6/c1-3-7-13(8-4-1)15-11-12-16-18(19-15)17(21-20-16)14-9-5-2-6-10-14;2*1-2/h1-12H,(H,20,21);2*1-2H3
InChIKeyRZVFCSFDPSUEQA-UHFFFAOYSA-N
MW331.46 g/mol
LogP6.34
Rot. Bonds2

About 3,5-diphenyl-1H-pyrazolo[4,3-b]pyridine;ethane

3,5-diphenyl-1H-pyrazolo[4,3-b]pyridine;ethane (PubChem CID 160775016) has the molecular formula C22H25N3 and a molecular weight of 331.46 g/mol. Its IUPAC name is 3,5-diphenyl-1H-pyrazolo[4,3-b]pyridine;ethane.

Molecular Properties

Compound Name3,5-diphenyl-1H-pyrazolo[4,3-b]pyridine;ethane
PubChem CID160775016
Molecular FormulaC22H25N3
Molecular Weight331.46 g/mol
Exact Mass331.20
IUPAC Name3,5-diphenyl-1H-pyrazolo[4,3-b]pyridine;ethane
SMILESCC.CC.c1ccc(-c2ccc3[nH]nc(-c4ccccc4)c3n2)cc1
InChIInChI=1S/C18H13N3.2C2H6/c1-3-7-13(8-4-1)15-11-12-16-18(19-15)17(21-20-16)14-9-5-2-6-10-14;2*1-2/h1-12H,(H,20,21);2*1-2H3
InChIKeyRZVFCSFDPSUEQA-UHFFFAOYSA-N
XLogP6.34
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500331.46
LogP ≤ 56.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,5-diphenyl-1H-pyrazolo[4,3-b]pyridine
CID 67256316
3,5-diphenyl-1H-pyrazolo[4,3-d]pyrimidine;ethane
CID 159273056
fluoroform;3-phenyl-1H-indazole
CID 160622015
5-ethoxy-3-phenyl-1H-pyrazolo[4,3-b]pyridine-6-carbonitrile
CID 76847130
1-[5-[3-(1H-indol-2-yl)-1H-pyrazolo[4,3-b]pyridin-5-yl]-3-pyridinyl]-N,N-dimethylmethanamine
CID 137114481
3-(3H-imidazo[4,5-c]pyridin-2-yl)-5-pyridin-3-yl-1H-pyrazolo[4,3-b]pyridine
CID 137038916
5-methyl-3-pyridin-3-yl-1H-pyrazolo[4,3-d]pyrimidine
CID 134337598
5-[3-(1H-benzimidazol-2-yl)-1H-pyrazolo[4,3-b]pyridin-5-yl]-N,N-dimethylpyridin-3-amine
CID 139424492
4,23-diphenyl-3,24-diazapentacyclo[18.4.0.02,7.08,13.014,19]tetracosa-1(20),2(7),3,5,8,10,12,14,16,18,21,23-dodecaene
CID 164778968
5-pyridin-4-yl-3-(1H-pyrrolo[3,2-c]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridine
CID 137039818
2-[3-[4-(4-methylpiperazin-1-yl)phenyl]-1H-pyrazolo[4,3-b]pyridin-5-yl]benzonitrile
CID 134327531
5-pyridin-4-yl-3-(7-pyridin-3-yl-3H-imidazo[4,5-c]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridine
CID 137110315

Frequently Asked Questions

What is the IUPAC name of 3,5-diphenyl-1H-pyrazolo[4,3-b]pyridine;ethane?
The IUPAC name of 3,5-diphenyl-1H-pyrazolo[4,3-b]pyridine;ethane (CID 160775016) is 3,5-diphenyl-1H-pyrazolo[4,3-b]pyridine;ethane.
What is the SMILES notation for 3,5-diphenyl-1H-pyrazolo[4,3-b]pyridine;ethane?
The canonical SMILES for 3,5-diphenyl-1H-pyrazolo[4,3-b]pyridine;ethane is CC.CC.c1ccc(-c2ccc3[nH]nc(-c4ccccc4)c3n2)cc1.
What is the InChIKey of 3,5-diphenyl-1H-pyrazolo[4,3-b]pyridine;ethane?
The InChIKey is RZVFCSFDPSUEQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13N3.2C2H6/c1-3-7-13(8-4-1)15-11-12-16-18(19-15)17(21-20-16)14-9-5-2-6-10-14;2*1-2/h1-12H,(H,20,21);2*1-2H3.
What are the key properties of 3,5-diphenyl-1H-pyrazolo[4,3-b]pyridine;ethane?
3,5-diphenyl-1H-pyrazolo[4,3-b]pyridine;ethane has a molecular weight of 331.46 g/mol, XLogP of 6.34, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-diphenyl-1H-pyrazolo[4,3-b]pyridine;ethane is sourced from PubChem (CID 160775016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).