N-ethyl-2-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide

C13H22N4O — CID 79470982

IUPACN-ethyl-2-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide
SMILESCCC(C)CN(CC)C(=O)c1ccnc(NN)c1
InChIInChI=1S/C13H22N4O/c1-4-10(3)9-17(5-2)13(18)11-6-7-15-12(8-11)16-14/h6-8,10H,4-5,9,14H2,1-3H3,(H,15,16)
InChIKeySMOFWTBONDURLZ-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.88
Rot. Bonds6

About N-ethyl-2-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide

N-ethyl-2-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide (PubChem CID 79470982) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is N-ethyl-2-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-ethyl-2-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide
PubChem CID79470982
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC NameN-ethyl-2-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide
SMILESCCC(C)CN(CC)C(=O)c1ccnc(NN)c1
InChIInChI=1S/C13H22N4O/c1-4-10(3)9-17(5-2)13(18)11-6-7-15-12(8-11)16-14/h6-8,10H,4-5,9,14H2,1-3H3,(H,15,16)
InChIKeySMOFWTBONDURLZ-UHFFFAOYSA-N
XLogP1.88
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 51.88
H-Bond Donors ≤ 52
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-2-(ethylamino)-N-(2-methylpropyl)pyridine-4-carboxamide
CID 55042857
N-ethyl-4-hydrazinyl-N-(2-methylbutyl)benzamide
CID 79470275
2-hydrazinyl-N,N-dimethylpyridine-4-carboxamide
CID 62236400
N-[2-[butan-2-yl(methyl)amino]ethyl]-2-hydrazinylpyridine-4-carboxamide
CID 114133340
N,N-diethyl-2-(ethylamino)pyridine-4-carboxamide
CID 62172696
N-(2,2-difluoroethyl)-2-hydrazinyl-N-(2-hydroxyethyl)pyridine-4-carboxamide
CID 107486289
2-hydrazinyl-N-(5-methylhexyl)pyridine-4-carboxamide
CID 115327351
2-hydrazinyl-N-(7-methyloctyl)pyridine-4-carboxamide
CID 107818117
N-ethyl-2-fluoro-N-(2-methylpropyl)pyridine-4-carboxamide
CID 61293621
N-[(2-hydrazinyl-4-pyridinyl)methyl]-N,2-dimethylbutan-1-amine
CID 62470146
3-amino-4-ethoxy-N-ethyl-N-(2-methylbutyl)benzamide
CID 79477369
2-(aminomethyl)-N-methyl-N-(2-methylbutyl)pyridine-4-carboxamide
CID 114325623

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide?
The IUPAC name of N-ethyl-2-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide (CID 79470982) is N-ethyl-2-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide.
What is the SMILES notation for N-ethyl-2-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide?
The canonical SMILES for N-ethyl-2-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide is CCC(C)CN(CC)C(=O)c1ccnc(NN)c1.
What is the InChIKey of N-ethyl-2-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide?
The InChIKey is SMOFWTBONDURLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-4-10(3)9-17(5-2)13(18)11-6-7-15-12(8-11)16-14/h6-8,10H,4-5,9,14H2,1-3H3,(H,15,16).
What are the key properties of N-ethyl-2-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide?
N-ethyl-2-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide has a molecular weight of 250.35 g/mol, XLogP of 1.88, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide is sourced from PubChem (CID 79470982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).