3-hydrazinyl-N-[1-(1H-imidazol-2-yl)propyl]pyridine-4-carboxamide

C12H16N6O — CID 105072502

IUPAC3-hydrazinyl-N-[1-(1H-imidazol-2-yl)propyl]pyridine-4-carboxamide
SMILESCCC(NC(=O)c1ccncc1NN)c1ncc[nH]1
InChIInChI=1S/C12H16N6O/c1-2-9(11-15-5-6-16-11)17-12(19)8-3-4-14-7-10(8)18-13/h3-7,9,18H,2,13H2,1H3,(H,15,16)(H,17,19)
InChIKeyVMNWHBTYEYTKEH-UHFFFAOYSA-N
MW260.30 g/mol
LogP0.97
Rot. Bonds5

About 3-hydrazinyl-N-[1-(1H-imidazol-2-yl)propyl]pyridine-4-carboxamide

3-hydrazinyl-N-[1-(1H-imidazol-2-yl)propyl]pyridine-4-carboxamide (PubChem CID 105072502) has the molecular formula C12H16N6O and a molecular weight of 260.30 g/mol. Its IUPAC name is 3-hydrazinyl-N-[1-(1H-imidazol-2-yl)propyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name3-hydrazinyl-N-[1-(1H-imidazol-2-yl)propyl]pyridine-4-carboxamide
PubChem CID105072502
Molecular FormulaC12H16N6O
Molecular Weight260.30 g/mol
Exact Mass260.14
IUPAC Name3-hydrazinyl-N-[1-(1H-imidazol-2-yl)propyl]pyridine-4-carboxamide
SMILESCCC(NC(=O)c1ccncc1NN)c1ncc[nH]1
InChIInChI=1S/C12H16N6O/c1-2-9(11-15-5-6-16-11)17-12(19)8-3-4-14-7-10(8)18-13/h3-7,9,18H,2,13H2,1H3,(H,15,16)(H,17,19)
InChIKeyVMNWHBTYEYTKEH-UHFFFAOYSA-N
XLogP0.97
TPSA108.72 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 50.97
H-Bond Donors ≤ 54
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

N-hexan-3-yl-3-hydrazinylpyridine-4-carboxamide
CID 105071655
1,3-bis[1-(1H-imidazol-2-yl)propyl]urea
CID 162195808
N-[1-(dimethylamino)propan-2-yl]-3-hydrazinylpyridine-4-carboxamide
CID 105072402
N-[2-(dimethylamino)propyl]-3-hydrazinylpyridine-4-carboxamide
CID 105071837
N-[2-(ethylamino)-2-oxoethyl]-3-hydrazinylpyridine-4-carboxamide
CID 105072034
N-[1-(4-bromophenyl)ethyl]-3-hydrazinylpyridine-4-carboxamide
CID 105071856
(2R)-2-amino-N-[1-(1H-imidazol-2-yl)propyl]-2-phenylacetamide
CID 104871611
N-hexan-3-yl-4-hydrazinylpyridine-3-carboxamide
CID 81256728
N-(4-ethoxyphenyl)-3-hydrazinylpyridine-4-carboxamide
CID 105071538
3-hydrazinyl-N-(4-methylpentyl)pyridine-4-carboxamide
CID 105072134
3-hydrazinyl-N-(2-methoxypropyl)pyridine-4-carboxamide
CID 102700639
N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-3-hydrazinylpyridine-4-carboxamide
CID 105071610

Frequently Asked Questions

What is the IUPAC name of 3-hydrazinyl-N-[1-(1H-imidazol-2-yl)propyl]pyridine-4-carboxamide?
The IUPAC name of 3-hydrazinyl-N-[1-(1H-imidazol-2-yl)propyl]pyridine-4-carboxamide (CID 105072502) is 3-hydrazinyl-N-[1-(1H-imidazol-2-yl)propyl]pyridine-4-carboxamide.
What is the SMILES notation for 3-hydrazinyl-N-[1-(1H-imidazol-2-yl)propyl]pyridine-4-carboxamide?
The canonical SMILES for 3-hydrazinyl-N-[1-(1H-imidazol-2-yl)propyl]pyridine-4-carboxamide is CCC(NC(=O)c1ccncc1NN)c1ncc[nH]1.
What is the InChIKey of 3-hydrazinyl-N-[1-(1H-imidazol-2-yl)propyl]pyridine-4-carboxamide?
The InChIKey is VMNWHBTYEYTKEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N6O/c1-2-9(11-15-5-6-16-11)17-12(19)8-3-4-14-7-10(8)18-13/h3-7,9,18H,2,13H2,1H3,(H,15,16)(H,17,19).
What are the key properties of 3-hydrazinyl-N-[1-(1H-imidazol-2-yl)propyl]pyridine-4-carboxamide?
3-hydrazinyl-N-[1-(1H-imidazol-2-yl)propyl]pyridine-4-carboxamide has a molecular weight of 260.30 g/mol, XLogP of 0.97, 5 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydrazinyl-N-[1-(1H-imidazol-2-yl)propyl]pyridine-4-carboxamide is sourced from PubChem (CID 105072502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).