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

C15H15N7O2 — CID 44571956

IUPAC2-(ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide
SMILESCCNC(=O)Nc1nc2cc(-c3cccnc3)cc(C(N)=O)n2n1
InChIInChI=1S/C15H15N7O2/c1-2-18-15(24)20-14-19-12-7-10(9-4-3-5-17-8-9)6-11(13(16)23)22(12)21-14/h3-8H,2H2,1H3,(H2,16,23)(H2,18,20,21,24)
InChIKeyKBPAOHVPWRLSIU-UHFFFAOYSA-N
MW325.33 g/mol
LogP1.03
Rot. Bonds4

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

2-(ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide (PubChem CID 44571956) has the molecular formula C15H15N7O2 and a molecular weight of 325.33 g/mol. Its IUPAC name is 2-(ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide.

Molecular Properties

Compound Name2-(ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide
PubChem CID44571956
Molecular FormulaC15H15N7O2
Molecular Weight325.33 g/mol
Exact Mass325.13
IUPAC Name2-(ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide
SMILESCCNC(=O)Nc1nc2cc(-c3cccnc3)cc(C(N)=O)n2n1
InChIInChI=1S/C15H15N7O2/c1-2-18-15(24)20-14-19-12-7-10(9-4-3-5-17-8-9)6-11(13(16)23)22(12)21-14/h3-8H,2H2,1H3,(H2,16,23)(H2,18,20,21,24)
InChIKeyKBPAOHVPWRLSIU-UHFFFAOYSA-N
XLogP1.03
TPSA127.30 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.33
LogP ≤ 51.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide?
The IUPAC name of 2-(ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide (CID 44571956) is 2-(ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide.
What is the SMILES notation for 2-(ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide?
The canonical SMILES for 2-(ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide is CCNC(=O)Nc1nc2cc(-c3cccnc3)cc(C(N)=O)n2n1.
What is the InChIKey of 2-(ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide?
The InChIKey is KBPAOHVPWRLSIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N7O2/c1-2-18-15(24)20-14-19-12-7-10(9-4-3-5-17-8-9)6-11(13(16)23)22(12)21-14/h3-8H,2H2,1H3,(H2,16,23)(H2,18,20,21,24).
What are the key properties of 2-(ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide?
2-(ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide has a molecular weight of 325.33 g/mol, XLogP of 1.03, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylcarbamoylamino)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxamide is sourced from PubChem (CID 44571956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).