7-(1,3-diphenylpropyl)-2H-triazolo[4,5-b]pyridin-5-amine

C20H19N5 — CID 145371646

IUPAC7-(1,3-diphenylpropyl)-2H-triazolo[4,5-b]pyridin-5-amine
SMILESNc1cc(C(CCc2ccccc2)c2ccccc2)c2n[nH]nc2n1
InChIInChI=1S/C20H19N5/c21-18-13-17(19-20(22-18)24-25-23-19)16(15-9-5-2-6-10-15)12-11-14-7-3-1-4-8-14/h1-10,13,16H,11-12H2,(H3,21,22,23,24,25)
InChIKeyVORBYFNQOACWGJ-UHFFFAOYSA-N
MW329.41 g/mol
LogP3.70
Rot. Bonds5

About 7-(1,3-diphenylpropyl)-2H-triazolo[4,5-b]pyridin-5-amine

7-(1,3-diphenylpropyl)-2H-triazolo[4,5-b]pyridin-5-amine (PubChem CID 145371646) has the molecular formula C20H19N5 and a molecular weight of 329.41 g/mol. Its IUPAC name is 7-(1,3-diphenylpropyl)-2H-triazolo[4,5-b]pyridin-5-amine.

Molecular Properties

Compound Name7-(1,3-diphenylpropyl)-2H-triazolo[4,5-b]pyridin-5-amine
PubChem CID145371646
Molecular FormulaC20H19N5
Molecular Weight329.41 g/mol
Exact Mass329.16
IUPAC Name7-(1,3-diphenylpropyl)-2H-triazolo[4,5-b]pyridin-5-amine
SMILESNc1cc(C(CCc2ccccc2)c2ccccc2)c2n[nH]nc2n1
InChIInChI=1S/C20H19N5/c21-18-13-17(19-20(22-18)24-25-23-19)16(15-9-5-2-6-10-15)12-11-14-7-3-1-4-8-14/h1-10,13,16H,11-12H2,(H3,21,22,23,24,25)
InChIKeyVORBYFNQOACWGJ-UHFFFAOYSA-N
XLogP3.70
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.41
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

L-158809
CID 183134
Luf-5962
CID 11617054
FK-739 free acid
CID 9801627
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CID 44373246
13-Amino-11-(4-methylphenyl)-1,8-diazatricyclo[7.4.0.0,2,7]trideca-2,4,6,8,10,12-hexaene-10,12-dicarbonitrile
CID 699043
8-cyclohexyl-2,6-diphenyl-9H-purine
CID 11523232
8-isopropyl-2,6-diphenyl-9H-purine
CID 11536936
5,7-diphenyl-2-propan-2-yl-1H-imidazo[4,5-b]pyridine
CID 16109428
2,6-Diphenyl-8-(1-ethylpropyl)-1-deazapurine
CID 16109429
2-cyclopentyl-5,7-diphenyl-1H-imidazo[4,5-b]pyridine
CID 16109430
2-cyclohexyl-5,7-di(phenyl)-1H-imidazo[4,5-b]pyridine
CID 16109435
2-(2-methylpropyl)-5,7-diphenyl-1H-imidazo[4,5-b]pyridine
CID 44418996

Frequently Asked Questions

What is the IUPAC name of 7-(1,3-diphenylpropyl)-2H-triazolo[4,5-b]pyridin-5-amine?
The IUPAC name of 7-(1,3-diphenylpropyl)-2H-triazolo[4,5-b]pyridin-5-amine (CID 145371646) is 7-(1,3-diphenylpropyl)-2H-triazolo[4,5-b]pyridin-5-amine.
What is the SMILES notation for 7-(1,3-diphenylpropyl)-2H-triazolo[4,5-b]pyridin-5-amine?
The canonical SMILES for 7-(1,3-diphenylpropyl)-2H-triazolo[4,5-b]pyridin-5-amine is Nc1cc(C(CCc2ccccc2)c2ccccc2)c2n[nH]nc2n1.
What is the InChIKey of 7-(1,3-diphenylpropyl)-2H-triazolo[4,5-b]pyridin-5-amine?
The InChIKey is VORBYFNQOACWGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N5/c21-18-13-17(19-20(22-18)24-25-23-19)16(15-9-5-2-6-10-15)12-11-14-7-3-1-4-8-14/h1-10,13,16H,11-12H2,(H3,21,22,23,24,25).
What are the key properties of 7-(1,3-diphenylpropyl)-2H-triazolo[4,5-b]pyridin-5-amine?
7-(1,3-diphenylpropyl)-2H-triazolo[4,5-b]pyridin-5-amine has a molecular weight of 329.41 g/mol, XLogP of 3.70, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(1,3-diphenylpropyl)-2H-triazolo[4,5-b]pyridin-5-amine is sourced from PubChem (CID 145371646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).