2-chloro-6-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide

C11H17ClN4O — CID 62692731

IUPAC2-chloro-6-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide
SMILESCCC(C)CNC(=O)c1cc(Cl)nc(NN)c1
InChIInChI=1S/C11H17ClN4O/c1-3-7(2)6-14-11(17)8-4-9(12)15-10(5-8)16-13/h4-5,7H,3,6,13H2,1-2H3,(H,14,17)(H,15,16)
InChIKeyIRWQGGHHVQTVOE-UHFFFAOYSA-N
MW256.74 g/mol
LogP1.80
Rot. Bonds5

About 2-chloro-6-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide

2-chloro-6-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide (PubChem CID 62692731) has the molecular formula C11H17ClN4O and a molecular weight of 256.74 g/mol. Its IUPAC name is 2-chloro-6-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-chloro-6-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide
PubChem CID62692731
Molecular FormulaC11H17ClN4O
Molecular Weight256.74 g/mol
Exact Mass256.11
IUPAC Name2-chloro-6-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide
SMILESCCC(C)CNC(=O)c1cc(Cl)nc(NN)c1
InChIInChI=1S/C11H17ClN4O/c1-3-7(2)6-14-11(17)8-4-9(12)15-10(5-8)16-13/h4-5,7H,3,6,13H2,1-2H3,(H,14,17)(H,15,16)
InChIKeyIRWQGGHHVQTVOE-UHFFFAOYSA-N
XLogP1.80
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.74
LogP ≤ 51.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-chloro-6-hydrazinyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-4-carboxamide
CID 55052122
2-chloro-N-(2-methylbutyl)-6-propylpyridine-4-carboxamide
CID 113379911
N-(2-acetamidoethyl)-2-chloro-6-hydrazinylpyridine-4-carboxamide
CID 62241958
2-chloro-N-hexan-3-yl-6-hydrazinylpyridine-4-carboxamide
CID 62236411
N-(2-amino-2-oxoethyl)-2-chloro-6-hydrazinylpyridine-4-carboxamide
CID 62248286
1-N,3-N,5-N-tris(2-methylbutyl)benzene-1,3,5-tricarboxamide
CID 70884498
2-chloro-6-hydrazinyl-N-[2-(methylamino)-2-oxoethyl]pyridine-4-carboxamide
CID 62241576
2-chloro-N-(2-ethoxyethyl)-6-hydrazinylpyridine-4-carboxamide
CID 62234303
2-chloro-N-(4-hydroxy-2-methylpentyl)-6-(methylamino)pyridine-4-carboxamide
CID 111447865
2-chloro-6-hydrazinyl-N-[3-oxo-3-(propylamino)propyl]pyridine-4-carboxamide
CID 62242208
N-(1-amino-1-oxopropan-2-yl)-2-chloro-6-hydrazinylpyridine-4-carboxamide
CID 62243041
N-(4-amino-4-oxobutyl)-2-chloro-6-hydrazinylpyridine-4-carboxamide
CID 62237080

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide?
The IUPAC name of 2-chloro-6-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide (CID 62692731) is 2-chloro-6-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-chloro-6-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide?
The canonical SMILES for 2-chloro-6-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide is CCC(C)CNC(=O)c1cc(Cl)nc(NN)c1.
What is the InChIKey of 2-chloro-6-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide?
The InChIKey is IRWQGGHHVQTVOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17ClN4O/c1-3-7(2)6-14-11(17)8-4-9(12)15-10(5-8)16-13/h4-5,7H,3,6,13H2,1-2H3,(H,14,17)(H,15,16).
What are the key properties of 2-chloro-6-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide?
2-chloro-6-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide has a molecular weight of 256.74 g/mol, XLogP of 1.80, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-hydrazinyl-N-(2-methylbutyl)pyridine-4-carboxamide is sourced from PubChem (CID 62692731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).