N-(5,6-dimethyl-1,2,4-triazin-3-yl)-4-(ethylamino)pyridine-3-carboxamide

C13H16N6O — CID 114389358

IUPACN-(5,6-dimethyl-1,2,4-triazin-3-yl)-4-(ethylamino)pyridine-3-carboxamide
SMILESCCNc1ccncc1C(=O)Nc1nnc(C)c(C)n1
InChIInChI=1S/C13H16N6O/c1-4-15-11-5-6-14-7-10(11)12(20)17-13-16-8(2)9(3)18-19-13/h5-7H,4H2,1-3H3,(H,14,15)(H,16,17,19,20)
InChIKeyRPLBWLJTBPJQHU-UHFFFAOYSA-N
MW272.31 g/mol
LogP1.57
Rot. Bonds4

About N-(5,6-dimethyl-1,2,4-triazin-3-yl)-4-(ethylamino)pyridine-3-carboxamide

N-(5,6-dimethyl-1,2,4-triazin-3-yl)-4-(ethylamino)pyridine-3-carboxamide (PubChem CID 114389358) has the molecular formula C13H16N6O and a molecular weight of 272.31 g/mol. Its IUPAC name is N-(5,6-dimethyl-1,2,4-triazin-3-yl)-4-(ethylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(5,6-dimethyl-1,2,4-triazin-3-yl)-4-(ethylamino)pyridine-3-carboxamide
PubChem CID114389358
Molecular FormulaC13H16N6O
Molecular Weight272.31 g/mol
Exact Mass272.14
IUPAC NameN-(5,6-dimethyl-1,2,4-triazin-3-yl)-4-(ethylamino)pyridine-3-carboxamide
SMILESCCNc1ccncc1C(=O)Nc1nnc(C)c(C)n1
InChIInChI=1S/C13H16N6O/c1-4-15-11-5-6-14-7-10(11)12(20)17-13-16-8(2)9(3)18-19-13/h5-7H,4H2,1-3H3,(H,14,15)(H,16,17,19,20)
InChIKeyRPLBWLJTBPJQHU-UHFFFAOYSA-N
XLogP1.57
TPSA92.69 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2,6-dimethyl-3-pyridinyl)-4-(ethylamino)pyridine-3-carboxamide
CID 81245038
4-(ethylamino)-N-(4-methyl-3-pyridinyl)pyridine-3-carboxamide
CID 81241556
4-(ethylamino)-N-(3-methylphenyl)pyridine-3-carboxamide
CID 81235983
4-(ethylamino)-N-(5-methyl-2-pyridinyl)pyridine-3-carboxamide
CID 81233596
N-(5,6-dimethyl-1,2,4-triazin-3-yl)-4-(ethylamino)-3-methylbenzamide
CID 114389344
4-(ethylamino)-N-(4-ethylphenyl)pyridine-3-carboxamide
CID 81235788
4-(ethylamino)-N-(4-fluorophenyl)pyridine-3-carboxamide
CID 81236169
N-(4,6-dimethylpyrimidin-2-yl)-4-(propylamino)pyridine-3-carboxamide
CID 81239346
N-(2-bromophenyl)-4-(ethylamino)pyridine-3-carboxamide
CID 81236092
4-(ethylamino)-N-propan-2-ylpyridine-3-carboxamide
CID 81236067
4-(ethylamino)-N-(5-fluoro-2-methylphenyl)pyridine-3-carboxamide
CID 81236730
N-(5-bromo-2-methylphenyl)-4-(ethylamino)pyridine-3-carboxamide
CID 81242957

Frequently Asked Questions

What is the IUPAC name of N-(5,6-dimethyl-1,2,4-triazin-3-yl)-4-(ethylamino)pyridine-3-carboxamide?
The IUPAC name of N-(5,6-dimethyl-1,2,4-triazin-3-yl)-4-(ethylamino)pyridine-3-carboxamide (CID 114389358) is N-(5,6-dimethyl-1,2,4-triazin-3-yl)-4-(ethylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(5,6-dimethyl-1,2,4-triazin-3-yl)-4-(ethylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(5,6-dimethyl-1,2,4-triazin-3-yl)-4-(ethylamino)pyridine-3-carboxamide is CCNc1ccncc1C(=O)Nc1nnc(C)c(C)n1.
What is the InChIKey of N-(5,6-dimethyl-1,2,4-triazin-3-yl)-4-(ethylamino)pyridine-3-carboxamide?
The InChIKey is RPLBWLJTBPJQHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N6O/c1-4-15-11-5-6-14-7-10(11)12(20)17-13-16-8(2)9(3)18-19-13/h5-7H,4H2,1-3H3,(H,14,15)(H,16,17,19,20).
What are the key properties of N-(5,6-dimethyl-1,2,4-triazin-3-yl)-4-(ethylamino)pyridine-3-carboxamide?
N-(5,6-dimethyl-1,2,4-triazin-3-yl)-4-(ethylamino)pyridine-3-carboxamide has a molecular weight of 272.31 g/mol, XLogP of 1.57, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5,6-dimethyl-1,2,4-triazin-3-yl)-4-(ethylamino)pyridine-3-carboxamide is sourced from PubChem (CID 114389358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).