6-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pyridine-2-carboxamide;hydrochloride

C11H15ClN6O — CID 119999188

IUPAC6-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pyridine-2-carboxamide;hydrochloride
SMILESCl.Cn1cnc(CCNC(=O)c2cccc(N)n2)n1
InChIInChI=1S/C11H14N6O.ClH/c1-17-7-14-10(16-17)5-6-13-11(18)8-3-2-4-9(12)15-8;/h2-4,7H,5-6H2,1H3,(H2,12,15)(H,13,18);1H
InChIKeyQDMBRDFXYAAGKI-UHFFFAOYSA-N
MW282.74 g/mol
LogP0.19
Rot. Bonds4

About 6-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pyridine-2-carboxamide;hydrochloride

6-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pyridine-2-carboxamide;hydrochloride (PubChem CID 119999188) has the molecular formula C11H15ClN6O and a molecular weight of 282.74 g/mol. Its IUPAC name is 6-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pyridine-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name6-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pyridine-2-carboxamide;hydrochloride
PubChem CID119999188
Molecular FormulaC11H15ClN6O
Molecular Weight282.74 g/mol
Exact Mass282.10
IUPAC Name6-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pyridine-2-carboxamide;hydrochloride
SMILESCl.Cn1cnc(CCNC(=O)c2cccc(N)n2)n1
InChIInChI=1S/C11H14N6O.ClH/c1-17-7-14-10(16-17)5-6-13-11(18)8-3-2-4-9(12)15-8;/h2-4,7H,5-6H2,1H3,(H2,12,15)(H,13,18);1H
InChIKeyQDMBRDFXYAAGKI-UHFFFAOYSA-N
XLogP0.19
TPSA98.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.74
LogP ≤ 50.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-amino-N-[2-(1-methylpyrazol-3-yl)ethyl]pyridine-2-carboxamide
CID 114144108
2-amino-6-methyl-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]benzamide
CID 80680803
2-hydrazinyl-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]benzamide
CID 80686371
6-amino-N-[2-(3,4-dimethoxyphenyl)ethyl]pyridine-2-carboxamide;hydrochloride
CID 119998901
2-(4-aminophenyl)-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]acetamide
CID 80680888
6-[2-(1-methyl-1,2,4-triazol-3-yl)ethylcarbamoyl]pyridine-3-carboxylic acid
CID 80688805
2-(2-aminoethyl)-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]-1,3-thiazole-4-carboxamide
CID 80682880
6-amino-N-(2-methylsulfonylethyl)pyridine-2-carboxamide
CID 62240593
6-amino-N-[2-[ethyl(methyl)amino]ethyl]pyridine-2-carboxamide
CID 62641667
6-amino-N-[3-(diethylamino)propyl]pyridine-2-carboxamide
CID 62238759
4-amino-2-chloro-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]benzamide
CID 80681439
6-amino-N-(2-pyrazol-1-ylethyl)pyridine-2-carboxamide
CID 62239354

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pyridine-2-carboxamide;hydrochloride?
The IUPAC name of 6-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pyridine-2-carboxamide;hydrochloride (CID 119999188) is 6-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pyridine-2-carboxamide;hydrochloride.
What is the SMILES notation for 6-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pyridine-2-carboxamide;hydrochloride?
The canonical SMILES for 6-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pyridine-2-carboxamide;hydrochloride is Cl.Cn1cnc(CCNC(=O)c2cccc(N)n2)n1.
What is the InChIKey of 6-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pyridine-2-carboxamide;hydrochloride?
The InChIKey is QDMBRDFXYAAGKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N6O.ClH/c1-17-7-14-10(16-17)5-6-13-11(18)8-3-2-4-9(12)15-8;/h2-4,7H,5-6H2,1H3,(H2,12,15)(H,13,18);1H.
What are the key properties of 6-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pyridine-2-carboxamide;hydrochloride?
6-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pyridine-2-carboxamide;hydrochloride has a molecular weight of 282.74 g/mol, XLogP of 0.19, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pyridine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119999188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).