5-hydrazinyl-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide

C12H13N5O — CID 104642246

IUPAC5-hydrazinyl-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide
SMILESNNc1ccc(C(=O)NCc2ccncc2)nc1
InChIInChI=1S/C12H13N5O/c13-17-10-1-2-11(15-8-10)12(18)16-7-9-3-5-14-6-4-9/h1-6,8,17H,7,13H2,(H,16,18)
InChIKeyFTRVODDWTLEXQX-UHFFFAOYSA-N
MW243.27 g/mol
LogP0.69
Rot. Bonds4

About 5-hydrazinyl-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide

5-hydrazinyl-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide (PubChem CID 104642246) has the molecular formula C12H13N5O and a molecular weight of 243.27 g/mol. Its IUPAC name is 5-hydrazinyl-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-hydrazinyl-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide
PubChem CID104642246
Molecular FormulaC12H13N5O
Molecular Weight243.27 g/mol
Exact Mass243.11
IUPAC Name5-hydrazinyl-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide
SMILESNNc1ccc(C(=O)NCc2ccncc2)nc1
InChIInChI=1S/C12H13N5O/c13-17-10-1-2-11(15-8-10)12(18)16-7-9-3-5-14-6-4-9/h1-6,8,17H,7,13H2,(H,16,18)
InChIKeyFTRVODDWTLEXQX-UHFFFAOYSA-N
XLogP0.69
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.27
LogP ≤ 50.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

5-(4-bromoanilino)-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide
CID 109191533
5-(4-acetamidoanilino)-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide
CID 109191552
N-[(4-methoxyphenyl)methyl]-5-(pyridin-4-ylmethylamino)pyridine-2-carboxamide
CID 109190359
N-[(3-bromophenyl)methyl]-5-hydrazinylpyridine-2-carboxamide
CID 113436329
5-phenyl-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide
CID 110683582
N-(2-methylpropyl)-5-(pyridin-4-ylmethylamino)pyridine-2-carboxamide
CID 109181042
5-[(2-methoxyphenyl)methylamino]-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide
CID 109190258
5-[(5-methyl-1,2-oxazol-3-yl)amino]-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide
CID 109191596
5-(pyridin-4-ylmethylcarbamoylamino)pyridine-2-carboxamide
CID 135223514
5-hydrazinyl-N-propylpyridine-2-carboxamide
CID 104642261
5-(3-methoxyanilino)-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide
CID 109191536
5-[2-(4-methoxyphenoxy)ethylamino]-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide
CID 109191483

Frequently Asked Questions

What is the IUPAC name of 5-hydrazinyl-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide?
The IUPAC name of 5-hydrazinyl-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide (CID 104642246) is 5-hydrazinyl-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-hydrazinyl-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide?
The canonical SMILES for 5-hydrazinyl-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide is NNc1ccc(C(=O)NCc2ccncc2)nc1.
What is the InChIKey of 5-hydrazinyl-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide?
The InChIKey is FTRVODDWTLEXQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N5O/c13-17-10-1-2-11(15-8-10)12(18)16-7-9-3-5-14-6-4-9/h1-6,8,17H,7,13H2,(H,16,18).
What are the key properties of 5-hydrazinyl-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide?
5-hydrazinyl-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide has a molecular weight of 243.27 g/mol, XLogP of 0.69, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydrazinyl-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide is sourced from PubChem (CID 104642246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).