3-fluoro-2-hydrazinyl-N-methyl-N-(3-methylbutyl)pyridine-4-carboxamide

C12H19FN4O — CID 105388166

IUPAC3-fluoro-2-hydrazinyl-N-methyl-N-(3-methylbutyl)pyridine-4-carboxamide
SMILESCC(C)CCN(C)C(=O)c1ccnc(NN)c1F
InChIInChI=1S/C12H19FN4O/c1-8(2)5-7-17(3)12(18)9-4-6-15-11(16-14)10(9)13/h4,6,8H,5,7,14H2,1-3H3,(H,15,16)
InChIKeySLBOXKIPKUKAFD-UHFFFAOYSA-N
MW254.31 g/mol
LogP1.62
Rot. Bonds5

About 3-fluoro-2-hydrazinyl-N-methyl-N-(3-methylbutyl)pyridine-4-carboxamide

3-fluoro-2-hydrazinyl-N-methyl-N-(3-methylbutyl)pyridine-4-carboxamide (PubChem CID 105388166) has the molecular formula C12H19FN4O and a molecular weight of 254.31 g/mol. Its IUPAC name is 3-fluoro-2-hydrazinyl-N-methyl-N-(3-methylbutyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-fluoro-2-hydrazinyl-N-methyl-N-(3-methylbutyl)pyridine-4-carboxamide
PubChem CID105388166
Molecular FormulaC12H19FN4O
Molecular Weight254.31 g/mol
Exact Mass254.15
IUPAC Name3-fluoro-2-hydrazinyl-N-methyl-N-(3-methylbutyl)pyridine-4-carboxamide
SMILESCC(C)CCN(C)C(=O)c1ccnc(NN)c1F
InChIInChI=1S/C12H19FN4O/c1-8(2)5-7-17(3)12(18)9-4-6-15-11(16-14)10(9)13/h4,6,8H,5,7,14H2,1-3H3,(H,15,16)
InChIKeySLBOXKIPKUKAFD-UHFFFAOYSA-N
XLogP1.62
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.31
LogP ≤ 51.62
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

2-amino-3-fluoro-N-methyl-N-(3-methylbutyl)pyridine-4-carboxamide
CID 105385823
N-butan-2-yl-N-ethyl-3-fluoro-2-hydrazinylpyridine-4-carboxamide
CID 105388218
N-butyl-N-ethyl-3-fluoro-2-hydrazinylpyridine-4-carboxamide
CID 105387835
3-fluoro-2-hydrazinyl-N-methyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide
CID 105387899
3-fluoro-2-hydrazinyl-N-[(4-hydroxyoxan-4-yl)methyl]-N-methylpyridine-4-carboxamide
CID 105388683
2-amino-3-fluoro-N-methyl-N-(2-methylpropyl)pyridine-4-carboxamide
CID 105384771
2-(ethylamino)-N-methyl-N-(3-methylbutyl)pyridine-3-carboxamide
CID 62178139
3-fluoro-2-hydrazinyl-N-(4-methoxybutan-2-yl)pyridine-4-carboxamide
CID 105388411
N-cyclopentyl-3-fluoro-2-hydrazinyl-N-methylpyridine-4-carboxamide
CID 105388215
N-(2-ethoxypropyl)-3-fluoro-2-hydrazinylpyridine-4-carboxamide
CID 105388610
3-fluoro-2-hydrazinylpyridine-4-carboxamide
CID 105388119
N-[2-(diethylamino)ethyl]-3-fluoro-2-hydrazinylpyridine-4-carboxamide
CID 105387949

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-2-hydrazinyl-N-methyl-N-(3-methylbutyl)pyridine-4-carboxamide?
The IUPAC name of 3-fluoro-2-hydrazinyl-N-methyl-N-(3-methylbutyl)pyridine-4-carboxamide (CID 105388166) is 3-fluoro-2-hydrazinyl-N-methyl-N-(3-methylbutyl)pyridine-4-carboxamide.
What is the SMILES notation for 3-fluoro-2-hydrazinyl-N-methyl-N-(3-methylbutyl)pyridine-4-carboxamide?
The canonical SMILES for 3-fluoro-2-hydrazinyl-N-methyl-N-(3-methylbutyl)pyridine-4-carboxamide is CC(C)CCN(C)C(=O)c1ccnc(NN)c1F.
What is the InChIKey of 3-fluoro-2-hydrazinyl-N-methyl-N-(3-methylbutyl)pyridine-4-carboxamide?
The InChIKey is SLBOXKIPKUKAFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19FN4O/c1-8(2)5-7-17(3)12(18)9-4-6-15-11(16-14)10(9)13/h4,6,8H,5,7,14H2,1-3H3,(H,15,16).
What are the key properties of 3-fluoro-2-hydrazinyl-N-methyl-N-(3-methylbutyl)pyridine-4-carboxamide?
3-fluoro-2-hydrazinyl-N-methyl-N-(3-methylbutyl)pyridine-4-carboxamide has a molecular weight of 254.31 g/mol, XLogP of 1.62, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-2-hydrazinyl-N-methyl-N-(3-methylbutyl)pyridine-4-carboxamide is sourced from PubChem (CID 105388166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).