N-hexan-3-yl-4-hydrazinylpyridine-3-carboxamide

C12H20N4O — CID 81256728

IUPACN-hexan-3-yl-4-hydrazinylpyridine-3-carboxamide
SMILESCCCC(CC)NC(=O)c1cnccc1NN
InChIInChI=1S/C12H20N4O/c1-3-5-9(4-2)15-12(17)10-8-14-7-6-11(10)16-13/h6-9H,3-5,13H2,1-2H3,(H,14,16)(H,15,17)
InChIKeyDDYXROBAVZKCLA-UHFFFAOYSA-N
MW236.32 g/mol
LogP1.68
Rot. Bonds6

About N-hexan-3-yl-4-hydrazinylpyridine-3-carboxamide

N-hexan-3-yl-4-hydrazinylpyridine-3-carboxamide (PubChem CID 81256728) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is N-hexan-3-yl-4-hydrazinylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-hexan-3-yl-4-hydrazinylpyridine-3-carboxamide
PubChem CID81256728
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC NameN-hexan-3-yl-4-hydrazinylpyridine-3-carboxamide
SMILESCCCC(CC)NC(=O)c1cnccc1NN
InChIInChI=1S/C12H20N4O/c1-3-5-9(4-2)15-12(17)10-8-14-7-6-11(10)16-13/h6-9H,3-5,13H2,1-2H3,(H,14,16)(H,15,17)
InChIKeyDDYXROBAVZKCLA-UHFFFAOYSA-N
XLogP1.68
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 51.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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
4-hydrazinyl-N-octan-4-ylpyridine-3-carboxamide
CID 114138357
N-hexan-3-yl-3-hydroxypyridine-4-carboxamide
CID 81442686
N-octan-4-yl-4-(propylamino)pyridine-3-carboxamide
CID 106027974
5-chloro-N-hexan-3-yl-2-hydrazinylbenzamide
CID 62235669
N-(1-cyclopropylbutan-2-yl)-4-(propylamino)pyridine-3-carboxamide
CID 81242102
N-heptan-2-yl-4-(methylamino)pyridine-3-carboxamide
CID 81240356
4-hydrazinyl-N-[1-(2H-tetrazol-5-yl)ethyl]pyridine-3-carboxamide
CID 81256281
N-hexan-3-yl-2-hydroxybenzamide
CID 62046226
4-(ethylamino)-N-propan-2-ylpyridine-3-carboxamide
CID 81236067
4-(ethylamino)-N-(2-methylpentan-3-yl)pyridine-3-carboxamide
CID 81242327
4-hydrazinyl-N-(3-methyl-4-pyridinyl)pyridine-3-carboxamide
CID 81249230

Frequently Asked Questions

What is the IUPAC name of N-hexan-3-yl-4-hydrazinylpyridine-3-carboxamide?
The IUPAC name of N-hexan-3-yl-4-hydrazinylpyridine-3-carboxamide (CID 81256728) is N-hexan-3-yl-4-hydrazinylpyridine-3-carboxamide.
What is the SMILES notation for N-hexan-3-yl-4-hydrazinylpyridine-3-carboxamide?
The canonical SMILES for N-hexan-3-yl-4-hydrazinylpyridine-3-carboxamide is CCCC(CC)NC(=O)c1cnccc1NN.
What is the InChIKey of N-hexan-3-yl-4-hydrazinylpyridine-3-carboxamide?
The InChIKey is DDYXROBAVZKCLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-3-5-9(4-2)15-12(17)10-8-14-7-6-11(10)16-13/h6-9H,3-5,13H2,1-2H3,(H,14,16)(H,15,17).
What are the key properties of N-hexan-3-yl-4-hydrazinylpyridine-3-carboxamide?
N-hexan-3-yl-4-hydrazinylpyridine-3-carboxamide has a molecular weight of 236.32 g/mol, XLogP of 1.68, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-hexan-3-yl-4-hydrazinylpyridine-3-carboxamide is sourced from PubChem (CID 81256728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).