1-propyl-3-(2-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)urea

C15H16N6O — CID 53190800

IUPAC1-propyl-3-(2-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)urea
SMILESCCCNC(=O)Nc1cccn2nc(-c3cccnc3)nc12
InChIInChI=1S/C15H16N6O/c1-2-7-17-15(22)18-12-6-4-9-21-14(12)19-13(20-21)11-5-3-8-16-10-11/h3-6,8-10H,2,7H2,1H3,(H2,17,18,22)
InChIKeyJMIWZNYKRMTBOA-UHFFFAOYSA-N
MW296.33 g/mol
LogP2.32
Rot. Bonds4

About 1-propyl-3-(2-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)urea

1-propyl-3-(2-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)urea (PubChem CID 53190800) has the molecular formula C15H16N6O and a molecular weight of 296.33 g/mol. Its IUPAC name is 1-propyl-3-(2-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)urea.

Molecular Properties

Compound Name1-propyl-3-(2-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)urea
PubChem CID53190800
Molecular FormulaC15H16N6O
Molecular Weight296.33 g/mol
Exact Mass296.14
IUPAC Name1-propyl-3-(2-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)urea
SMILESCCCNC(=O)Nc1cccn2nc(-c3cccnc3)nc12
InChIInChI=1S/C15H16N6O/c1-2-7-17-15(22)18-12-6-4-9-21-14(12)19-13(20-21)11-5-3-8-16-10-11/h3-6,8-10H,2,7H2,1H3,(H2,17,18,22)
InChIKeyJMIWZNYKRMTBOA-UHFFFAOYSA-N
XLogP2.32
TPSA84.21 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.33
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-methylphenoxy)-N-(2-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)acetamide
CID 53190798
(2R)-N-(2-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)oxolane-2-carboxamide
CID 95110051
2-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylic acid
CID 82565551
1-(1-ethyl-3-methylpyrazol-4-yl)-3-[2-(3-pyridin-3-yl-1H-1,2,4-triazol-5-yl)ethyl]urea
CID 72864109
1-propyl-3-quinolin-8-ylurea
CID 13078451
1-butyl-3-(2-oxo-6-pyridin-3-ylpyran-3-yl)urea
CID 67108655
4-amino-N-propyl-2-pyridin-3-ylpyrimidine-5-carboxamide
CID 83567475
1-[2-(4-methyl-5-oxo-3-pyridin-3-yl-1,2,4-triazol-1-yl)ethyl]-3-[2-(trifluoromethyl)phenyl]urea
CID 121078344
1-propyl-3-(2-pyridin-3-ylethyl)urea
CID 115578203
3-[(5-methyl-2-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]-N-propylbenzamide
CID 53046018
bis(1-butyl-3-isoquinolin-8-ylurea);platinum(2+);bis(pyridine);dibromide
CID 139180676
1-(2-phenoxy-3-pyridinyl)-3-propylurea
CID 47041336

Frequently Asked Questions

What is the IUPAC name of 1-propyl-3-(2-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)urea?
The IUPAC name of 1-propyl-3-(2-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)urea (CID 53190800) is 1-propyl-3-(2-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)urea.
What is the SMILES notation for 1-propyl-3-(2-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)urea?
The canonical SMILES for 1-propyl-3-(2-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)urea is CCCNC(=O)Nc1cccn2nc(-c3cccnc3)nc12.
What is the InChIKey of 1-propyl-3-(2-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)urea?
The InChIKey is JMIWZNYKRMTBOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N6O/c1-2-7-17-15(22)18-12-6-4-9-21-14(12)19-13(20-21)11-5-3-8-16-10-11/h3-6,8-10H,2,7H2,1H3,(H2,17,18,22).
What are the key properties of 1-propyl-3-(2-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)urea?
1-propyl-3-(2-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)urea has a molecular weight of 296.33 g/mol, XLogP of 2.32, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propyl-3-(2-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)urea is sourced from PubChem (CID 53190800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).