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

C14H21BrN4O — CID 62406728

IUPAC5-bromo-N-(1-cyclohexylethyl)-2-hydrazinylpyridine-3-carboxamide
SMILESCC(NC(=O)c1cc(Br)cnc1NN)C1CCCCC1
InChIInChI=1S/C14H21BrN4O/c1-9(10-5-3-2-4-6-10)18-14(20)12-7-11(15)8-17-13(12)19-16/h7-10H,2-6,16H2,1H3,(H,17,19)(H,18,20)
InChIKeyNVHDGYPPOFHHOA-UHFFFAOYSA-N
MW341.25 g/mol
LogP2.83
Rot. Bonds4

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

5-bromo-N-(1-cyclohexylethyl)-2-hydrazinylpyridine-3-carboxamide (PubChem CID 62406728) has the molecular formula C14H21BrN4O and a molecular weight of 341.25 g/mol. Its IUPAC name is 5-bromo-N-(1-cyclohexylethyl)-2-hydrazinylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(1-cyclohexylethyl)-2-hydrazinylpyridine-3-carboxamide
PubChem CID62406728
Molecular FormulaC14H21BrN4O
Molecular Weight341.25 g/mol
Exact Mass340.09
IUPAC Name5-bromo-N-(1-cyclohexylethyl)-2-hydrazinylpyridine-3-carboxamide
SMILESCC(NC(=O)c1cc(Br)cnc1NN)C1CCCCC1
InChIInChI=1S/C14H21BrN4O/c1-9(10-5-3-2-4-6-10)18-14(20)12-7-11(15)8-17-13(12)19-16/h7-10H,2-6,16H2,1H3,(H,17,19)(H,18,20)
InChIKeyNVHDGYPPOFHHOA-UHFFFAOYSA-N
XLogP2.83
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.25
LogP ≤ 52.83
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-cyclopropylethyl)-2-hydrazinylpyridine-3-carboxamide
CID 62242129
5-bromo-N-(3-ethylpentan-2-yl)-2-hydrazinylpyridine-3-carboxamide
CID 63838972
5-bromo-N-(1-cyclohexylethyl)-2-methylbenzamide
CID 65309722
5-bromo-2-hydrazinyl-N-(1-methoxypropan-2-yl)pyridine-3-carboxamide
CID 62236680
5-bromo-2-hydrazinyl-N-(2-methylcyclopentyl)pyridine-3-carboxamide
CID 63279137
5-bromo-2-hydrazinyl-N-[1-(4-methylphenyl)ethyl]pyridine-3-carboxamide
CID 62248977
2-amino-3,5-dibromo-N-(1-cyclopropylethyl)benzamide
CID 89420130
5-bromo-N-(2-cyclohexyloxyethyl)-2-hydrazinylpyridine-3-carboxamide
CID 63833624
5-bromo-N-(1,1-dioxothian-4-yl)-2-hydrazinylpyridine-3-carboxamide
CID 62237432
N-(1-cyclopropylethyl)-1-hydrazinylisoquinoline-4-carboxamide
CID 106773929
3,5-dibromo-N-(1-cyclopropylethyl)pyridine-2-carboxamide
CID 75522226
3-amino-5-bromo-N-(1-cyclobutylethyl)-2-methylbenzamide
CID 107873151

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(1-cyclohexylethyl)-2-hydrazinylpyridine-3-carboxamide?
The IUPAC name of 5-bromo-N-(1-cyclohexylethyl)-2-hydrazinylpyridine-3-carboxamide (CID 62406728) is 5-bromo-N-(1-cyclohexylethyl)-2-hydrazinylpyridine-3-carboxamide.
What is the SMILES notation for 5-bromo-N-(1-cyclohexylethyl)-2-hydrazinylpyridine-3-carboxamide?
The canonical SMILES for 5-bromo-N-(1-cyclohexylethyl)-2-hydrazinylpyridine-3-carboxamide is CC(NC(=O)c1cc(Br)cnc1NN)C1CCCCC1.
What is the InChIKey of 5-bromo-N-(1-cyclohexylethyl)-2-hydrazinylpyridine-3-carboxamide?
The InChIKey is NVHDGYPPOFHHOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21BrN4O/c1-9(10-5-3-2-4-6-10)18-14(20)12-7-11(15)8-17-13(12)19-16/h7-10H,2-6,16H2,1H3,(H,17,19)(H,18,20).
What are the key properties of 5-bromo-N-(1-cyclohexylethyl)-2-hydrazinylpyridine-3-carboxamide?
5-bromo-N-(1-cyclohexylethyl)-2-hydrazinylpyridine-3-carboxamide has a molecular weight of 341.25 g/mol, XLogP of 2.83, 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-cyclohexylethyl)-2-hydrazinylpyridine-3-carboxamide is sourced from PubChem (CID 62406728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).