5-bromo-2-hydrazinyl-N-(3-methylbutyl)pyridine-3-carboxamide

C11H17BrN4O — CID 62237644

IUPAC5-bromo-2-hydrazinyl-N-(3-methylbutyl)pyridine-3-carboxamide
SMILESCC(C)CCNC(=O)c1cc(Br)cnc1NN
InChIInChI=1S/C11H17BrN4O/c1-7(2)3-4-14-11(17)9-5-8(12)6-15-10(9)16-13/h5-7H,3-4,13H2,1-2H3,(H,14,17)(H,15,16)
InChIKeyULHYWXMLKTYVIV-UHFFFAOYSA-N
MW301.19 g/mol
LogP1.91
Rot. Bonds5

About 5-bromo-2-hydrazinyl-N-(3-methylbutyl)pyridine-3-carboxamide

5-bromo-2-hydrazinyl-N-(3-methylbutyl)pyridine-3-carboxamide (PubChem CID 62237644) has the molecular formula C11H17BrN4O and a molecular weight of 301.19 g/mol. Its IUPAC name is 5-bromo-2-hydrazinyl-N-(3-methylbutyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-bromo-2-hydrazinyl-N-(3-methylbutyl)pyridine-3-carboxamide
PubChem CID62237644
Molecular FormulaC11H17BrN4O
Molecular Weight301.19 g/mol
Exact Mass300.06
IUPAC Name5-bromo-2-hydrazinyl-N-(3-methylbutyl)pyridine-3-carboxamide
SMILESCC(C)CCNC(=O)c1cc(Br)cnc1NN
InChIInChI=1S/C11H17BrN4O/c1-7(2)3-4-14-11(17)9-5-8(12)6-15-10(9)16-13/h5-7H,3-4,13H2,1-2H3,(H,14,17)(H,15,16)
InChIKeyULHYWXMLKTYVIV-UHFFFAOYSA-N
XLogP1.91
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.19
LogP ≤ 51.91
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

2-amino-5-bromo-N-(3-methylbutyl)pyridine-3-carboxamide
CID 62152701
5-bromo-2-hydrazinyl-N-(3-methoxypropyl)pyridine-3-carboxamide
CID 62242203
5-bromo-N-[3-(butan-2-ylamino)-3-oxopropyl]-2-hydrazinylpyridine-3-carboxamide
CID 62242574
5-bromo-2-hydrazinyl-N-(2-methoxypropyl)pyridine-3-carboxamide
CID 102700643
5-bromo-N-(4-methylpentyl)-2-(propylamino)pyridine-3-carboxamide
CID 63499563
5-bromo-2-hydrazinyl-N-(4,4,4-trifluorobutyl)pyridine-3-carboxamide
CID 113328075
5-bromo-N-(2-butoxyethyl)-2-hydrazinylpyridine-3-carboxamide
CID 62242770
5-bromo-N-[2-[cyclopropyl(methyl)amino]ethyl]-2-hydrazinylpyridine-3-carboxamide
CID 62979826
5-bromo-N-(3-ethylpentan-2-yl)-2-hydrazinylpyridine-3-carboxamide
CID 63838972
2-amino-5-bromo-N-(5-methylhexyl)pyridine-3-carboxamide
CID 113287868
5-bromo-2-hydrazinyl-N-(2-methylpropyl)-N-pentan-3-ylpyridine-3-carboxamide
CID 79487064
5-bromo-2-hydrazinyl-N-(3-phenylpropyl)pyridine-3-carboxamide
CID 62238180

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-hydrazinyl-N-(3-methylbutyl)pyridine-3-carboxamide?
The IUPAC name of 5-bromo-2-hydrazinyl-N-(3-methylbutyl)pyridine-3-carboxamide (CID 62237644) is 5-bromo-2-hydrazinyl-N-(3-methylbutyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-bromo-2-hydrazinyl-N-(3-methylbutyl)pyridine-3-carboxamide?
The canonical SMILES for 5-bromo-2-hydrazinyl-N-(3-methylbutyl)pyridine-3-carboxamide is CC(C)CCNC(=O)c1cc(Br)cnc1NN.
What is the InChIKey of 5-bromo-2-hydrazinyl-N-(3-methylbutyl)pyridine-3-carboxamide?
The InChIKey is ULHYWXMLKTYVIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17BrN4O/c1-7(2)3-4-14-11(17)9-5-8(12)6-15-10(9)16-13/h5-7H,3-4,13H2,1-2H3,(H,14,17)(H,15,16).
What are the key properties of 5-bromo-2-hydrazinyl-N-(3-methylbutyl)pyridine-3-carboxamide?
5-bromo-2-hydrazinyl-N-(3-methylbutyl)pyridine-3-carboxamide has a molecular weight of 301.19 g/mol, XLogP of 1.91, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-hydrazinyl-N-(3-methylbutyl)pyridine-3-carboxamide is sourced from PubChem (CID 62237644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).