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

C13H18N6O — CID 106304155

IUPAC6-(ethylamino)-N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]pyridine-2-carboxamide
SMILESCCNc1cccc(C(=O)NCc2nncn2CC)n1
InChIInChI=1S/C13H18N6O/c1-3-14-11-7-5-6-10(17-11)13(20)15-8-12-18-16-9-19(12)4-2/h5-7,9H,3-4,8H2,1-2H3,(H,14,17)(H,15,20)
InChIKeyOGJWDBKWLLNMKC-UHFFFAOYSA-N
MW274.33 g/mol
LogP1.05
Rot. Bonds6

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

6-(ethylamino)-N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]pyridine-2-carboxamide (PubChem CID 106304155) has the molecular formula C13H18N6O and a molecular weight of 274.33 g/mol. Its IUPAC name is 6-(ethylamino)-N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-(ethylamino)-N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]pyridine-2-carboxamide
PubChem CID106304155
Molecular FormulaC13H18N6O
Molecular Weight274.33 g/mol
Exact Mass274.15
IUPAC Name6-(ethylamino)-N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]pyridine-2-carboxamide
SMILESCCNc1cccc(C(=O)NCc2nncn2CC)n1
InChIInChI=1S/C13H18N6O/c1-3-14-11-7-5-6-10(17-11)13(20)15-8-12-18-16-9-19(12)4-2/h5-7,9H,3-4,8H2,1-2H3,(H,14,17)(H,15,20)
InChIKeyOGJWDBKWLLNMKC-UHFFFAOYSA-N
XLogP1.05
TPSA84.73 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.33
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-6-(methylamino)pyrazine-2-carboxamide
CID 106304126
6-hydrazinyl-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]pyridine-2-carboxamide
CID 62237331
6-(ethylamino)-N-[(4-fluorophenyl)methyl]pyridine-2-carboxamide
CID 62239102
N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-6-oxo-1H-pyridine-2-carboxamide
CID 114170961
N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-6-hydrazinylpyridin-2-amine
CID 106304580
2-amino-N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-6-methylbenzamide
CID 106301555
N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-1H-indole-7-carboxamide
CID 103706853
N-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]-6-(propylamino)pyridine-2-carboxamide
CID 63330785
N-(4-amino-4-oxobutyl)-6-(ethylamino)pyridine-2-carboxamide
CID 62239477
4-(aminomethyl)-N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]benzamide;dihydrochloride
CID 119855022
6-(ethylamino)-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]pyridazine-3-carboxamide
CID 62180418
N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-2-(propylamino)benzamide
CID 106303592

Frequently Asked Questions

What is the IUPAC name of 6-(ethylamino)-N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]pyridine-2-carboxamide?
The IUPAC name of 6-(ethylamino)-N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]pyridine-2-carboxamide (CID 106304155) is 6-(ethylamino)-N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]pyridine-2-carboxamide.
What is the SMILES notation for 6-(ethylamino)-N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]pyridine-2-carboxamide?
The canonical SMILES for 6-(ethylamino)-N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]pyridine-2-carboxamide is CCNc1cccc(C(=O)NCc2nncn2CC)n1.
What is the InChIKey of 6-(ethylamino)-N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]pyridine-2-carboxamide?
The InChIKey is OGJWDBKWLLNMKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N6O/c1-3-14-11-7-5-6-10(17-11)13(20)15-8-12-18-16-9-19(12)4-2/h5-7,9H,3-4,8H2,1-2H3,(H,14,17)(H,15,20).
What are the key properties of 6-(ethylamino)-N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]pyridine-2-carboxamide?
6-(ethylamino)-N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]pyridine-2-carboxamide has a molecular weight of 274.33 g/mol, XLogP of 1.05, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(ethylamino)-N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]pyridine-2-carboxamide is sourced from PubChem (CID 106304155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).