4-ethyl-N-[5-(pyrrolidine-1-carbonyl)-2H-triazol-4-yl]pyridine-2-carboxamide

C15H18N6O2 — CID 166230700

IUPAC4-ethyl-N-[5-(pyrrolidine-1-carbonyl)-2H-triazol-4-yl]pyridine-2-carboxamide
SMILESCCc1ccnc(C(=O)Nc2n[nH]nc2C(=O)N2CCCC2)c1
InChIInChI=1S/C15H18N6O2/c1-2-10-5-6-16-11(9-10)14(22)17-13-12(18-20-19-13)15(23)21-7-3-4-8-21/h5-6,9H,2-4,7-8H2,1H3,(H2,17,18,19,20,22)
InChIKeyITVKXAUARBUJTO-UHFFFAOYSA-N
MW314.35 g/mol
LogP1.25
Rot. Bonds4

About 4-ethyl-N-[5-(pyrrolidine-1-carbonyl)-2H-triazol-4-yl]pyridine-2-carboxamide

4-ethyl-N-[5-(pyrrolidine-1-carbonyl)-2H-triazol-4-yl]pyridine-2-carboxamide (PubChem CID 166230700) has the molecular formula C15H18N6O2 and a molecular weight of 314.35 g/mol. Its IUPAC name is 4-ethyl-N-[5-(pyrrolidine-1-carbonyl)-2H-triazol-4-yl]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-ethyl-N-[5-(pyrrolidine-1-carbonyl)-2H-triazol-4-yl]pyridine-2-carboxamide
PubChem CID166230700
Molecular FormulaC15H18N6O2
Molecular Weight314.35 g/mol
Exact Mass314.15
IUPAC Name4-ethyl-N-[5-(pyrrolidine-1-carbonyl)-2H-triazol-4-yl]pyridine-2-carboxamide
SMILESCCc1ccnc(C(=O)Nc2n[nH]nc2C(=O)N2CCCC2)c1
InChIInChI=1S/C15H18N6O2/c1-2-10-5-6-16-11(9-10)14(22)17-13-12(18-20-19-13)15(23)21-7-3-4-8-21/h5-6,9H,2-4,7-8H2,1H3,(H2,17,18,19,20,22)
InChIKeyITVKXAUARBUJTO-UHFFFAOYSA-N
XLogP1.25
TPSA103.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.35
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-methyl-6-oxo-N-[5-(pyrrolidine-1-carbonyl)-2H-triazol-4-yl]pyridine-2-carboxamide
CID 166230701
4-(azepane-1-carbonyl)-N-(2,6-diethylphenyl)pyridine-2-carboxamide
CID 109090661
4-ethyl-N-(6-fluoro-1H-indazol-3-yl)pyridine-2-carboxamide
CID 155949720
4-(4-acetylpiperazine-1-carbonyl)-N-(4-ethylphenyl)pyridine-2-carboxamide
CID 109084898
azepan-1-yl-[4-(4-ethylanilino)-2-pyridinyl]methanone
CID 109218552
N-(4-ethylphenyl)-4-piperidin-1-ylpyridine-2-carboxamide
CID 109204642
2-(4-fluorophenyl)-N-[5-(pyrrolidine-1-carbonyl)-2H-triazol-4-yl]butanamide
CID 166237482
methyl 4-[[4-(azepane-1-carbonyl)pyridine-2-carbonyl]amino]benzoate
CID 109090698
1-[4-(4-ethylpyridine-2-carbonyl)piperazin-1-yl]-2-morpholin-4-ylethanone
CID 138998600
N-methyl-N-[[2-(pyrrolidine-1-carbonyl)-4-pyridinyl]methyl]acetamide
CID 178152323
N-phenyl-4-(piperidine-1-carbonyl)pyridine-2-carboxamide
CID 109081096
N-(2-methylphenyl)-4-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
CID 109080395

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[5-(pyrrolidine-1-carbonyl)-2H-triazol-4-yl]pyridine-2-carboxamide?
The IUPAC name of 4-ethyl-N-[5-(pyrrolidine-1-carbonyl)-2H-triazol-4-yl]pyridine-2-carboxamide (CID 166230700) is 4-ethyl-N-[5-(pyrrolidine-1-carbonyl)-2H-triazol-4-yl]pyridine-2-carboxamide.
What is the SMILES notation for 4-ethyl-N-[5-(pyrrolidine-1-carbonyl)-2H-triazol-4-yl]pyridine-2-carboxamide?
The canonical SMILES for 4-ethyl-N-[5-(pyrrolidine-1-carbonyl)-2H-triazol-4-yl]pyridine-2-carboxamide is CCc1ccnc(C(=O)Nc2n[nH]nc2C(=O)N2CCCC2)c1.
What is the InChIKey of 4-ethyl-N-[5-(pyrrolidine-1-carbonyl)-2H-triazol-4-yl]pyridine-2-carboxamide?
The InChIKey is ITVKXAUARBUJTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N6O2/c1-2-10-5-6-16-11(9-10)14(22)17-13-12(18-20-19-13)15(23)21-7-3-4-8-21/h5-6,9H,2-4,7-8H2,1H3,(H2,17,18,19,20,22).
What are the key properties of 4-ethyl-N-[5-(pyrrolidine-1-carbonyl)-2H-triazol-4-yl]pyridine-2-carboxamide?
4-ethyl-N-[5-(pyrrolidine-1-carbonyl)-2H-triazol-4-yl]pyridine-2-carboxamide has a molecular weight of 314.35 g/mol, XLogP of 1.25, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[5-(pyrrolidine-1-carbonyl)-2H-triazol-4-yl]pyridine-2-carboxamide is sourced from PubChem (CID 166230700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).