N-propan-2-yl-2-(6-pyridin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)morpholine-4-carboxamide

C19H22N6O2 — CID 131670953

IUPACN-propan-2-yl-2-(6-pyridin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)morpholine-4-carboxamide
SMILESCC(C)NC(=O)N1CCOC(c2nc3ccc(-c4ccncc4)cn3n2)C1
InChIInChI=1S/C19H22N6O2/c1-13(2)21-19(26)24-9-10-27-16(12-24)18-22-17-4-3-15(11-25(17)23-18)14-5-7-20-8-6-14/h3-8,11,13,16H,9-10,12H2,1-2H3,(H,21,26)
InChIKeyGKRPFZMNSINKRP-UHFFFAOYSA-N
MW366.43 g/mol
LogP2.28
Rot. Bonds3

About N-propan-2-yl-2-(6-pyridin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)morpholine-4-carboxamide

N-propan-2-yl-2-(6-pyridin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)morpholine-4-carboxamide (PubChem CID 131670953) has the molecular formula C19H22N6O2 and a molecular weight of 366.43 g/mol. Its IUPAC name is N-propan-2-yl-2-(6-pyridin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-propan-2-yl-2-(6-pyridin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)morpholine-4-carboxamide
PubChem CID131670953
Molecular FormulaC19H22N6O2
Molecular Weight366.43 g/mol
Exact Mass366.18
IUPAC NameN-propan-2-yl-2-(6-pyridin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)morpholine-4-carboxamide
SMILESCC(C)NC(=O)N1CCOC(c2nc3ccc(-c4ccncc4)cn3n2)C1
InChIInChI=1S/C19H22N6O2/c1-13(2)21-19(26)24-9-10-27-16(12-24)18-22-17-4-3-15(11-25(17)23-18)14-5-7-20-8-6-14/h3-8,11,13,16H,9-10,12H2,1-2H3,(H,21,26)
InChIKeyGKRPFZMNSINKRP-UHFFFAOYSA-N
XLogP2.28
TPSA84.65 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.43
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-2-(6-pyridin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)morpholine-4-carboxamide?
The IUPAC name of N-propan-2-yl-2-(6-pyridin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)morpholine-4-carboxamide (CID 131670953) is N-propan-2-yl-2-(6-pyridin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)morpholine-4-carboxamide.
What is the SMILES notation for N-propan-2-yl-2-(6-pyridin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)morpholine-4-carboxamide?
The canonical SMILES for N-propan-2-yl-2-(6-pyridin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)morpholine-4-carboxamide is CC(C)NC(=O)N1CCOC(c2nc3ccc(-c4ccncc4)cn3n2)C1.
What is the InChIKey of N-propan-2-yl-2-(6-pyridin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)morpholine-4-carboxamide?
The InChIKey is GKRPFZMNSINKRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N6O2/c1-13(2)21-19(26)24-9-10-27-16(12-24)18-22-17-4-3-15(11-25(17)23-18)14-5-7-20-8-6-14/h3-8,11,13,16H,9-10,12H2,1-2H3,(H,21,26).
What are the key properties of N-propan-2-yl-2-(6-pyridin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)morpholine-4-carboxamide?
N-propan-2-yl-2-(6-pyridin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)morpholine-4-carboxamide has a molecular weight of 366.43 g/mol, XLogP of 2.28, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-2-(6-pyridin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)morpholine-4-carboxamide is sourced from PubChem (CID 131670953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).