N-ethyl-2-(ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide

C17H19N7O2 — CID 25195131

IUPACN-ethyl-2-(ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide
SMILESCCNC(=O)Nc1nc2cc(-c3cccnc3)cc(C(=O)NCC)n2n1
InChIInChI=1S/C17H19N7O2/c1-3-19-15(25)13-8-12(11-6-5-7-18-10-11)9-14-21-16(23-24(13)14)22-17(26)20-4-2/h5-10H,3-4H2,1-2H3,(H,19,25)(H2,20,22,23,26)
InChIKeyPELNZYZPRBCDPP-UHFFFAOYSA-N
MW353.39 g/mol
LogP1.68
Rot. Bonds5

About N-ethyl-2-(ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide

N-ethyl-2-(ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide (PubChem CID 25195131) has the molecular formula C17H19N7O2 and a molecular weight of 353.39 g/mol. Its IUPAC name is N-ethyl-2-(ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide.

Molecular Properties

Compound NameN-ethyl-2-(ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide
PubChem CID25195131
Molecular FormulaC17H19N7O2
Molecular Weight353.39 g/mol
Exact Mass353.16
IUPAC NameN-ethyl-2-(ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide
SMILESCCNC(=O)Nc1nc2cc(-c3cccnc3)cc(C(=O)NCC)n2n1
InChIInChI=1S/C17H19N7O2/c1-3-19-15(25)13-8-12(11-6-5-7-18-10-11)9-14-21-16(23-24(13)14)22-17(26)20-4-2/h5-10H,3-4H2,1-2H3,(H,19,25)(H2,20,22,23,26)
InChIKeyPELNZYZPRBCDPP-UHFFFAOYSA-N
XLogP1.68
TPSA113.31 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.39
LogP ≤ 51.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide?
The IUPAC name of N-ethyl-2-(ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide (CID 25195131) is N-ethyl-2-(ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide.
What is the SMILES notation for N-ethyl-2-(ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide?
The canonical SMILES for N-ethyl-2-(ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide is CCNC(=O)Nc1nc2cc(-c3cccnc3)cc(C(=O)NCC)n2n1.
What is the InChIKey of N-ethyl-2-(ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide?
The InChIKey is PELNZYZPRBCDPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N7O2/c1-3-19-15(25)13-8-12(11-6-5-7-18-10-11)9-14-21-16(23-24(13)14)22-17(26)20-4-2/h5-10H,3-4H2,1-2H3,(H,19,25)(H2,20,22,23,26).
What are the key properties of N-ethyl-2-(ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide?
N-ethyl-2-(ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide has a molecular weight of 353.39 g/mol, XLogP of 1.68, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide is sourced from PubChem (CID 25195131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).