N-(3-ethylpentan-3-yl)-6-hydrazinylpyridine-3-carboxamide

C13H22N4O — CID 65042874

IUPACN-(3-ethylpentan-3-yl)-6-hydrazinylpyridine-3-carboxamide
SMILESCCC(CC)(CC)NC(=O)c1ccc(NN)nc1
InChIInChI=1S/C13H22N4O/c1-4-13(5-2,6-3)16-12(18)10-7-8-11(17-14)15-9-10/h7-9H,4-6,14H2,1-3H3,(H,15,17)(H,16,18)
InChIKeyWLCDRUPWLTVXOC-UHFFFAOYSA-N
MW250.35 g/mol
LogP2.07
Rot. Bonds6

About N-(3-ethylpentan-3-yl)-6-hydrazinylpyridine-3-carboxamide

N-(3-ethylpentan-3-yl)-6-hydrazinylpyridine-3-carboxamide (PubChem CID 65042874) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is N-(3-ethylpentan-3-yl)-6-hydrazinylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-ethylpentan-3-yl)-6-hydrazinylpyridine-3-carboxamide
PubChem CID65042874
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC NameN-(3-ethylpentan-3-yl)-6-hydrazinylpyridine-3-carboxamide
SMILESCCC(CC)(CC)NC(=O)c1ccc(NN)nc1
InChIInChI=1S/C13H22N4O/c1-4-13(5-2,6-3)16-12(18)10-7-8-11(17-14)15-9-10/h7-9H,4-6,14H2,1-3H3,(H,15,17)(H,16,18)
InChIKeyWLCDRUPWLTVXOC-UHFFFAOYSA-N
XLogP2.07
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 52.07
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-ethyl-6-hydrazinylpyridine-3-carboxamide
CID 20734038
6-hydrazinylpyridine-3-carboxylic acid
CID 3782617
hydrazine;6-hydrazinylpyridine-3-carboxylic acid
CID 166604204
6-hydrazinyl-N-pentan-3-ylpyridine-3-carboxamide
CID 62247178
6-hydrazinyl-N-methylpyridine-3-carboxamide;technetium-99
CID 2826732
N-[1-chloro-2-(chloromethyl)butan-2-yl]-6-methylpyridine-3-carboxamide
CID 107867635
N-(3-ethylpentan-3-yl)-5-hydrazinylpyridine-2-carboxamide
CID 104642862
N-[3-(aminomethyl)pentan-3-yl]-6-(trifluoromethyl)pyridine-3-carboxamide;dihydrochloride
CID 119570954
N-(3-ethylpentan-3-yl)-6-hydrazinylpyridine-2-carboxamide
CID 65042969
N-cyclooctyl-6-hydrazinylpyridine-3-carboxamide
CID 62237790
6-hydrazinyl-N-[(4-methylphenyl)methyl]pyridine-3-carboxamide
CID 51370237
4-(aminomethyl)-N-(3-ethylpentan-3-yl)benzamide;hydrochloride
CID 119334920

Frequently Asked Questions

What is the IUPAC name of N-(3-ethylpentan-3-yl)-6-hydrazinylpyridine-3-carboxamide?
The IUPAC name of N-(3-ethylpentan-3-yl)-6-hydrazinylpyridine-3-carboxamide (CID 65042874) is N-(3-ethylpentan-3-yl)-6-hydrazinylpyridine-3-carboxamide.
What is the SMILES notation for N-(3-ethylpentan-3-yl)-6-hydrazinylpyridine-3-carboxamide?
The canonical SMILES for N-(3-ethylpentan-3-yl)-6-hydrazinylpyridine-3-carboxamide is CCC(CC)(CC)NC(=O)c1ccc(NN)nc1.
What is the InChIKey of N-(3-ethylpentan-3-yl)-6-hydrazinylpyridine-3-carboxamide?
The InChIKey is WLCDRUPWLTVXOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-4-13(5-2,6-3)16-12(18)10-7-8-11(17-14)15-9-10/h7-9H,4-6,14H2,1-3H3,(H,15,17)(H,16,18).
What are the key properties of N-(3-ethylpentan-3-yl)-6-hydrazinylpyridine-3-carboxamide?
N-(3-ethylpentan-3-yl)-6-hydrazinylpyridine-3-carboxamide has a molecular weight of 250.35 g/mol, XLogP of 2.07, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethylpentan-3-yl)-6-hydrazinylpyridine-3-carboxamide is sourced from PubChem (CID 65042874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).