4-hydrazinyl-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide

C12H13N5O — CID 81255921

IUPAC4-hydrazinyl-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide
SMILESNNc1ccncc1C(=O)NCc1ccccn1
InChIInChI=1S/C12H13N5O/c13-17-11-4-6-14-8-10(11)12(18)16-7-9-3-1-2-5-15-9/h1-6,8H,7,13H2,(H,14,17)(H,16,18)
InChIKeySASYOBINOALCFI-UHFFFAOYSA-N
MW243.27 g/mol
LogP0.69
Rot. Bonds4

About 4-hydrazinyl-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide

4-hydrazinyl-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide (PubChem CID 81255921) has the molecular formula C12H13N5O and a molecular weight of 243.27 g/mol. Its IUPAC name is 4-hydrazinyl-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name4-hydrazinyl-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide
PubChem CID81255921
Molecular FormulaC12H13N5O
Molecular Weight243.27 g/mol
Exact Mass243.11
IUPAC Name4-hydrazinyl-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide
SMILESNNc1ccncc1C(=O)NCc1ccccn1
InChIInChI=1S/C12H13N5O/c13-17-11-4-6-14-8-10(11)12(18)16-7-9-3-1-2-5-15-9/h1-6,8H,7,13H2,(H,14,17)(H,16,18)
InChIKeySASYOBINOALCFI-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

4-hydrazinyl-6-methyl-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 81255827
4-hydrazinyl-N-[(2-methylpyrimidin-4-yl)methyl]pyridine-3-carboxamide
CID 81255907
4-(methylamino)-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide
CID 81235207
4-hydrazinyl-N-[(3-methylthiophen-2-yl)methyl]pyridine-3-carboxamide
CID 81248898
6-methyl-4-(methylamino)-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 81236822
2-acetamido-N-(pyridin-2-ylmethyl)benzamide
CID 783556
4-(methylamino)-N-(pyridazin-3-ylmethyl)pyridine-3-carboxamide
CID 106897669
2-(ethylamino)-N-(pyridin-2-ylmethyl)benzamide
CID 62167465
5-amino-2-methyl-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 54914226
N-(4-amino-4-oxobutyl)-4-hydrazinylpyridine-3-carboxamide
CID 81256347
2-amino-3-methyl-N-(pyridin-2-ylmethyl)benzamide
CID 16787973
N-[(3-cyanophenyl)methyl]-4-hydrazinylpyridine-3-carboxamide
CID 81256233

Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of 4-hydrazinyl-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide (CID 81255921) is 4-hydrazinyl-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for 4-hydrazinyl-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for 4-hydrazinyl-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide is NNc1ccncc1C(=O)NCc1ccccn1.
What is the InChIKey of 4-hydrazinyl-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide?
The InChIKey is SASYOBINOALCFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N5O/c13-17-11-4-6-14-8-10(11)12(18)16-7-9-3-1-2-5-15-9/h1-6,8H,7,13H2,(H,14,17)(H,16,18).
What are the key properties of 4-hydrazinyl-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide?
4-hydrazinyl-N-(pyridin-2-ylmethyl)pyridine-3-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 4-hydrazinyl-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 81255921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).