N-[5-(3-oxopiperazin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide

C14H16N6O2 — CID 70929601

IUPACN-[5-(3-oxopiperazin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
SMILESO=C1CN(c2cccc3nc(NC(=O)C4CC4)nn23)CCN1
InChIInChI=1S/C14H16N6O2/c21-11-8-19(7-6-15-11)12-3-1-2-10-16-14(18-20(10)12)17-13(22)9-4-5-9/h1-3,9H,4-8H2,(H,15,21)(H,17,18,22)
InChIKeyCRSVXLYDEXSLMF-UHFFFAOYSA-N
MW300.32 g/mol
LogP0.01
Rot. Bonds3

About N-[5-(3-oxopiperazin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide

N-[5-(3-oxopiperazin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide (PubChem CID 70929601) has the molecular formula C14H16N6O2 and a molecular weight of 300.32 g/mol. Its IUPAC name is N-[5-(3-oxopiperazin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[5-(3-oxopiperazin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
PubChem CID70929601
Molecular FormulaC14H16N6O2
Molecular Weight300.32 g/mol
Exact Mass300.13
IUPAC NameN-[5-(3-oxopiperazin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
SMILESO=C1CN(c2cccc3nc(NC(=O)C4CC4)nn23)CCN1
InChIInChI=1S/C14H16N6O2/c21-11-8-19(7-6-15-11)12-3-1-2-10-16-14(18-20(10)12)17-13(22)9-4-5-9/h1-3,9H,4-8H2,(H,15,21)(H,17,18,22)
InChIKeyCRSVXLYDEXSLMF-UHFFFAOYSA-N
XLogP0.01
TPSA91.63 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.32
LogP ≤ 50.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-[4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]piperazin-1-yl]benzoic acid
CID 70929702
N-[5-[4-(3,4-dichlorophenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide;ethane
CID 143929704
N-[5-(4-benzyl-4-hydroxypiperidin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
CID 44622594
N-[5-[4-(ethoxymethyl)piperidin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
CID 44622130
N-[5-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
CID 91090467
N-[5-[4-[2-(dipropylamino)ethyl]piperidin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
CID 70929386
N-[5-[4-(2-pyridin-3-ylacetyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
CID 70929717
N-[5-[4-[(3-cyanophenyl)methyl]piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
CID 70929698
4-[2-(cyclopropanecarbonylamino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]-N-(4-piperidin-1-ylphenyl)piperazine-1-carboxamide
CID 70929649
N-(5-phenyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropanecarboxamide
CID 24798484
N-[5-[4-[(4-cyanophenyl)sulfonylamino]piperidin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
CID 70929607
N-[5-[4-[(2,3-dichlorophenyl)sulfanylamino]piperidin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
CID 143929700

Frequently Asked Questions

What is the IUPAC name of N-[5-(3-oxopiperazin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide?
The IUPAC name of N-[5-(3-oxopiperazin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide (CID 70929601) is N-[5-(3-oxopiperazin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-[5-(3-oxopiperazin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide?
The canonical SMILES for N-[5-(3-oxopiperazin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide is O=C1CN(c2cccc3nc(NC(=O)C4CC4)nn23)CCN1.
What is the InChIKey of N-[5-(3-oxopiperazin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide?
The InChIKey is CRSVXLYDEXSLMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N6O2/c21-11-8-19(7-6-15-11)12-3-1-2-10-16-14(18-20(10)12)17-13(22)9-4-5-9/h1-3,9H,4-8H2,(H,15,21)(H,17,18,22).
What are the key properties of N-[5-(3-oxopiperazin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide?
N-[5-(3-oxopiperazin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide has a molecular weight of 300.32 g/mol, XLogP of 0.01, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(3-oxopiperazin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide is sourced from PubChem (CID 70929601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).