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

C12H20N4O — CID 105071655

IUPACN-hexan-3-yl-3-hydrazinylpyridine-4-carboxamide
SMILESCCCC(CC)NC(=O)c1ccncc1NN
InChIInChI=1S/C12H20N4O/c1-3-5-9(4-2)15-12(17)10-6-7-14-8-11(10)16-13/h6-9,16H,3-5,13H2,1-2H3,(H,15,17)
InChIKeyCFEBQYNKNPQJCY-UHFFFAOYSA-N
MW236.32 g/mol
LogP1.68
Rot. Bonds6

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

N-hexan-3-yl-3-hydrazinylpyridine-4-carboxamide (PubChem CID 105071655) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is N-hexan-3-yl-3-hydrazinylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-hexan-3-yl-3-hydrazinylpyridine-4-carboxamide
PubChem CID105071655
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC NameN-hexan-3-yl-3-hydrazinylpyridine-4-carboxamide
SMILESCCCC(CC)NC(=O)c1ccncc1NN
InChIInChI=1S/C12H20N4O/c1-3-5-9(4-2)15-12(17)10-6-7-14-8-11(10)16-13/h6-9,16H,3-5,13H2,1-2H3,(H,15,17)
InChIKeyCFEBQYNKNPQJCY-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-4-hydrazinylpyridine-3-carboxamide
CID 81256728
N-hexan-3-yl-3-hydroxypyridine-4-carboxamide
CID 81442686
4-hydrazinyl-N-octan-4-ylpyridine-3-carboxamide
CID 114138357
3-hydrazinyl-N-[1-(1H-imidazol-2-yl)propyl]pyridine-4-carboxamide
CID 105072502
5-chloro-N-hexan-3-yl-2-hydrazinylbenzamide
CID 62235669
N-[1-(dimethylamino)propan-2-yl]-3-hydrazinylpyridine-4-carboxamide
CID 105072402
3-(ethylamino)-N-(1-methylsulfanylbutan-2-yl)pyridine-4-carboxamide
CID 105071292
N-[2-(dimethylamino)propyl]-3-hydrazinylpyridine-4-carboxamide
CID 105071837
3-hydrazinyl-N-(4-methylpentyl)pyridine-4-carboxamide
CID 105072134
N-[2-(ethylamino)-2-oxoethyl]-3-hydrazinylpyridine-4-carboxamide
CID 105072034
N-[1-(4-bromophenyl)ethyl]-3-hydrazinylpyridine-4-carboxamide
CID 105071856
N-(1-chloropentan-3-yl)-3-methoxypyridine-4-carboxamide
CID 105064609

Frequently Asked Questions

What is the IUPAC name of N-hexan-3-yl-3-hydrazinylpyridine-4-carboxamide?
The IUPAC name of N-hexan-3-yl-3-hydrazinylpyridine-4-carboxamide (CID 105071655) is N-hexan-3-yl-3-hydrazinylpyridine-4-carboxamide.
What is the SMILES notation for N-hexan-3-yl-3-hydrazinylpyridine-4-carboxamide?
The canonical SMILES for N-hexan-3-yl-3-hydrazinylpyridine-4-carboxamide is CCCC(CC)NC(=O)c1ccncc1NN.
What is the InChIKey of N-hexan-3-yl-3-hydrazinylpyridine-4-carboxamide?
The InChIKey is CFEBQYNKNPQJCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-3-5-9(4-2)15-12(17)10-6-7-14-8-11(10)16-13/h6-9,16H,3-5,13H2,1-2H3,(H,15,17).
What are the key properties of N-hexan-3-yl-3-hydrazinylpyridine-4-carboxamide?
N-hexan-3-yl-3-hydrazinylpyridine-4-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-3-hydrazinylpyridine-4-carboxamide is sourced from PubChem (CID 105071655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).