N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)oxane-3-carboxamide

C15H20N4O2 — CID 154741097

IUPACN-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)oxane-3-carboxamide
SMILESCC(C)c1nnc2ccc(NC(=O)C3CCCOC3)cn12
InChIInChI=1S/C15H20N4O2/c1-10(2)14-18-17-13-6-5-12(8-19(13)14)16-15(20)11-4-3-7-21-9-11/h5-6,8,10-11H,3-4,7,9H2,1-2H3,(H,16,20)
InChIKeyZQJMERRHLWGULS-UHFFFAOYSA-N
MW288.35 g/mol
LogP2.22
Rot. Bonds3

About N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)oxane-3-carboxamide

N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)oxane-3-carboxamide (PubChem CID 154741097) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)oxane-3-carboxamide.

Molecular Properties

Compound NameN-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)oxane-3-carboxamide
PubChem CID154741097
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC NameN-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)oxane-3-carboxamide
SMILESCC(C)c1nnc2ccc(NC(=O)C3CCCOC3)cn12
InChIInChI=1S/C15H20N4O2/c1-10(2)14-18-17-13-6-5-12(8-19(13)14)16-15(20)11-4-3-7-21-9-11/h5-6,8,10-11H,3-4,7,9H2,1-2H3,(H,16,20)
InChIKeyZQJMERRHLWGULS-UHFFFAOYSA-N
XLogP2.22
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-oxo-1-propan-2-yl-N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)pyrrolidine-3-carboxamide
CID 126786172
(3S)-4-(2,2-difluoroethyl)-N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)morpholine-3-carboxamide
CID 99827106
N-[4-(4-methylpiperidin-1-yl)phenyl]oxane-3-carboxamide
CID 110862273
3-amino-N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)pyrrolidine-1-carboxamide
CID 128757010
1-(2-hydroxybenzoyl)-N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)pyrrolidine-2-carboxamide
CID 126785198
N-(3-amino-4-ethylphenyl)oxane-3-carboxamide
CID 63010461
N-(4-pyrrolidin-1-ylphenyl)oxane-3-carboxamide
CID 110862080
4-[6-(cyclobutanecarbonylamino)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]-N-propan-2-ylbenzamide
CID 53159880
N-(3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)cyclopropanecarboxamide
CID 53014288
N-[4-(1-amino-2-methylpropan-2-yl)phenyl]oxane-3-carboxamide
CID 63010280
4,4-difluoro-3-methyl-N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)piperidine-1-carboxamide
CID 154737713
1-(3-chloro-4-methylphenyl)-3-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)urea
CID 50846563

Frequently Asked Questions

What is the IUPAC name of N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)oxane-3-carboxamide?
The IUPAC name of N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)oxane-3-carboxamide (CID 154741097) is N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)oxane-3-carboxamide.
What is the SMILES notation for N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)oxane-3-carboxamide?
The canonical SMILES for N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)oxane-3-carboxamide is CC(C)c1nnc2ccc(NC(=O)C3CCCOC3)cn12.
What is the InChIKey of N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)oxane-3-carboxamide?
The InChIKey is ZQJMERRHLWGULS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-10(2)14-18-17-13-6-5-12(8-19(13)14)16-15(20)11-4-3-7-21-9-11/h5-6,8,10-11H,3-4,7,9H2,1-2H3,(H,16,20).
What are the key properties of N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)oxane-3-carboxamide?
N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)oxane-3-carboxamide has a molecular weight of 288.35 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)oxane-3-carboxamide is sourced from PubChem (CID 154741097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).