5-bromo-N-(1-cyclopropylethyl)-2-hydrazinylpyridine-3-carboxamide

C11H15BrN4O — CID 62242129

IUPAC5-bromo-N-(1-cyclopropylethyl)-2-hydrazinylpyridine-3-carboxamide
SMILESCC(NC(=O)c1cc(Br)cnc1NN)C1CC1
InChIInChI=1S/C11H15BrN4O/c1-6(7-2-3-7)15-11(17)9-4-8(12)5-14-10(9)16-13/h4-7H,2-3,13H2,1H3,(H,14,16)(H,15,17)
InChIKeyXIIAUUNBJCQNKT-UHFFFAOYSA-N
MW299.17 g/mol
LogP1.66
Rot. Bonds4

About 5-bromo-N-(1-cyclopropylethyl)-2-hydrazinylpyridine-3-carboxamide

5-bromo-N-(1-cyclopropylethyl)-2-hydrazinylpyridine-3-carboxamide (PubChem CID 62242129) has the molecular formula C11H15BrN4O and a molecular weight of 299.17 g/mol. Its IUPAC name is 5-bromo-N-(1-cyclopropylethyl)-2-hydrazinylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(1-cyclopropylethyl)-2-hydrazinylpyridine-3-carboxamide
PubChem CID62242129
Molecular FormulaC11H15BrN4O
Molecular Weight299.17 g/mol
Exact Mass298.04
IUPAC Name5-bromo-N-(1-cyclopropylethyl)-2-hydrazinylpyridine-3-carboxamide
SMILESCC(NC(=O)c1cc(Br)cnc1NN)C1CC1
InChIInChI=1S/C11H15BrN4O/c1-6(7-2-3-7)15-11(17)9-4-8(12)5-14-10(9)16-13/h4-7H,2-3,13H2,1H3,(H,14,16)(H,15,17)
InChIKeyXIIAUUNBJCQNKT-UHFFFAOYSA-N
XLogP1.66
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.17
LogP ≤ 51.66
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

5-bromo-N-(1-cyclohexylethyl)-2-hydrazinylpyridine-3-carboxamide
CID 62406728
2-amino-3,5-dibromo-N-(1-cyclopropylethyl)benzamide
CID 89420130
5-bromo-N-(3-ethylpentan-2-yl)-2-hydrazinylpyridine-3-carboxamide
CID 63838972
5-bromo-2-hydrazinyl-N-(1-methoxypropan-2-yl)pyridine-3-carboxamide
CID 62236680
N-(1-cyclopropylethyl)-1-hydrazinylisoquinoline-4-carboxamide
CID 106773929
3,5-dibromo-N-(1-cyclopropylethyl)pyridine-2-carboxamide
CID 75522226
5-bromo-2-hydrazinyl-N-[1-(4-methylphenyl)ethyl]pyridine-3-carboxamide
CID 62248977
5-bromo-2-hydrazinyl-N-(2-methylcyclopentyl)pyridine-3-carboxamide
CID 63279137
5-bromo-2-hydrazinyl-N-(3-methylbutyl)pyridine-3-carboxamide
CID 62237644
5-bromo-N-tert-butyl-2-hydrazinylpyridine-3-carboxamide
CID 62238273
5-bromo-N-(5-bromo-3-methyl-2-pyridinyl)-2-hydrazinylpyridine-3-carboxamide
CID 83170019
5-bromo-N-(1-cyclopropylethyl)-2-methylbenzamide
CID 65306796

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(1-cyclopropylethyl)-2-hydrazinylpyridine-3-carboxamide?
The IUPAC name of 5-bromo-N-(1-cyclopropylethyl)-2-hydrazinylpyridine-3-carboxamide (CID 62242129) is 5-bromo-N-(1-cyclopropylethyl)-2-hydrazinylpyridine-3-carboxamide.
What is the SMILES notation for 5-bromo-N-(1-cyclopropylethyl)-2-hydrazinylpyridine-3-carboxamide?
The canonical SMILES for 5-bromo-N-(1-cyclopropylethyl)-2-hydrazinylpyridine-3-carboxamide is CC(NC(=O)c1cc(Br)cnc1NN)C1CC1.
What is the InChIKey of 5-bromo-N-(1-cyclopropylethyl)-2-hydrazinylpyridine-3-carboxamide?
The InChIKey is XIIAUUNBJCQNKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrN4O/c1-6(7-2-3-7)15-11(17)9-4-8(12)5-14-10(9)16-13/h4-7H,2-3,13H2,1H3,(H,14,16)(H,15,17).
What are the key properties of 5-bromo-N-(1-cyclopropylethyl)-2-hydrazinylpyridine-3-carboxamide?
5-bromo-N-(1-cyclopropylethyl)-2-hydrazinylpyridine-3-carboxamide has a molecular weight of 299.17 g/mol, XLogP of 1.66, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(1-cyclopropylethyl)-2-hydrazinylpyridine-3-carboxamide is sourced from PubChem (CID 62242129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).