2-hydrazinyl-6-propan-2-yl-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyridine-4-carboxamide

C13H19N7O — CID 106283116

IUPAC2-hydrazinyl-6-propan-2-yl-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyridine-4-carboxamide
SMILESCC(C)c1cc(C(=O)NC(C)c2ncn[nH]2)cc(NN)n1
InChIInChI=1S/C13H19N7O/c1-7(2)10-4-9(5-11(18-10)19-14)13(21)17-8(3)12-15-6-16-20-12/h4-8H,14H2,1-3H3,(H,17,21)(H,18,19)(H,15,16,20)
InChIKeyIXQAJTXFLIADJU-UHFFFAOYSA-N
MW289.34 g/mol
LogP1.10
Rot. Bonds5

About 2-hydrazinyl-6-propan-2-yl-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyridine-4-carboxamide

2-hydrazinyl-6-propan-2-yl-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyridine-4-carboxamide (PubChem CID 106283116) has the molecular formula C13H19N7O and a molecular weight of 289.34 g/mol. Its IUPAC name is 2-hydrazinyl-6-propan-2-yl-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-hydrazinyl-6-propan-2-yl-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyridine-4-carboxamide
PubChem CID106283116
Molecular FormulaC13H19N7O
Molecular Weight289.34 g/mol
Exact Mass289.17
IUPAC Name2-hydrazinyl-6-propan-2-yl-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyridine-4-carboxamide
SMILESCC(C)c1cc(C(=O)NC(C)c2ncn[nH]2)cc(NN)n1
InChIInChI=1S/C13H19N7O/c1-7(2)10-4-9(5-11(18-10)19-14)13(21)17-8(3)12-15-6-16-20-12/h4-8H,14H2,1-3H3,(H,17,21)(H,18,19)(H,15,16,20)
InChIKeyIXQAJTXFLIADJU-UHFFFAOYSA-N
XLogP1.10
TPSA121.61 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 51.10
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-hydrazinyl-6-propan-2-yl-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyridine-4-carboxamide with MolForge

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Related Compounds

N-[1-(1H-1,2,4-triazol-5-yl)ethyl]naphthalene-2-carboxamide
CID 103716304
6-hydrazinyl-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyridazine-3-carboxamide
CID 106283109
5-hydroxy-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyridine-3-carboxamide
CID 103725984
N-(5-amino-5-oxopentyl)-2-hydrazinyl-6-propan-2-ylpyridine-4-carboxamide
CID 106241285
N-(3-amino-2,2-dimethyl-3-oxopropyl)-2-hydrazinyl-6-propan-2-ylpyridine-4-carboxamide
CID 106280242
2-chloro-6-propyl-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyridine-4-carboxamide
CID 106281903
3-amino-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]-1H-pyrazole-5-carboxamide
CID 106281052
2-hydrazinyl-6-propan-2-yl-N-(2,2,3,3-tetrafluoropropyl)pyridine-4-carboxamide
CID 106295635
2-hydrazinyl-6-propan-2-yl-N-(1,2,4-triazin-3-yl)pyridine-4-carboxamide
CID 114389598
4-bromo-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]-1H-pyrrole-2-carboxamide
CID 103722970
N-[1-(1H-1,2,4-triazol-5-yl)ethyl]thiophene-3-carboxamide
CID 103716265
5-hydrazinyl-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyridine-2-carboxamide
CID 106283130

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-6-propan-2-yl-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyridine-4-carboxamide?
The IUPAC name of 2-hydrazinyl-6-propan-2-yl-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyridine-4-carboxamide (CID 106283116) is 2-hydrazinyl-6-propan-2-yl-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-hydrazinyl-6-propan-2-yl-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyridine-4-carboxamide?
The canonical SMILES for 2-hydrazinyl-6-propan-2-yl-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyridine-4-carboxamide is CC(C)c1cc(C(=O)NC(C)c2ncn[nH]2)cc(NN)n1.
What is the InChIKey of 2-hydrazinyl-6-propan-2-yl-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyridine-4-carboxamide?
The InChIKey is IXQAJTXFLIADJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N7O/c1-7(2)10-4-9(5-11(18-10)19-14)13(21)17-8(3)12-15-6-16-20-12/h4-8H,14H2,1-3H3,(H,17,21)(H,18,19)(H,15,16,20).
What are the key properties of 2-hydrazinyl-6-propan-2-yl-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyridine-4-carboxamide?
2-hydrazinyl-6-propan-2-yl-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyridine-4-carboxamide has a molecular weight of 289.34 g/mol, XLogP of 1.10, 5 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-6-propan-2-yl-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyridine-4-carboxamide is sourced from PubChem (CID 106283116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).