5-bromo-N-(2-cyclohexyloxyethyl)-2-hydrazinylpyridine-3-carboxamide

C14H21BrN4O2 — CID 63833624

IUPAC5-bromo-N-(2-cyclohexyloxyethyl)-2-hydrazinylpyridine-3-carboxamide
SMILESNNc1ncc(Br)cc1C(=O)NCCOC1CCCCC1
InChIInChI=1S/C14H21BrN4O2/c15-10-8-12(13(19-16)18-9-10)14(20)17-6-7-21-11-4-2-1-3-5-11/h8-9,11H,1-7,16H2,(H,17,20)(H,18,19)
InChIKeyKGHBWCOKVSJHQN-UHFFFAOYSA-N
MW357.25 g/mol
LogP2.21
Rot. Bonds6

About 5-bromo-N-(2-cyclohexyloxyethyl)-2-hydrazinylpyridine-3-carboxamide

5-bromo-N-(2-cyclohexyloxyethyl)-2-hydrazinylpyridine-3-carboxamide (PubChem CID 63833624) has the molecular formula C14H21BrN4O2 and a molecular weight of 357.25 g/mol. Its IUPAC name is 5-bromo-N-(2-cyclohexyloxyethyl)-2-hydrazinylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(2-cyclohexyloxyethyl)-2-hydrazinylpyridine-3-carboxamide
PubChem CID63833624
Molecular FormulaC14H21BrN4O2
Molecular Weight357.25 g/mol
Exact Mass356.08
IUPAC Name5-bromo-N-(2-cyclohexyloxyethyl)-2-hydrazinylpyridine-3-carboxamide
SMILESNNc1ncc(Br)cc1C(=O)NCCOC1CCCCC1
InChIInChI=1S/C14H21BrN4O2/c15-10-8-12(13(19-16)18-9-10)14(20)17-6-7-21-11-4-2-1-3-5-11/h8-9,11H,1-7,16H2,(H,17,20)(H,18,19)
InChIKeyKGHBWCOKVSJHQN-UHFFFAOYSA-N
XLogP2.21
TPSA89.27 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.25
LogP ≤ 52.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

5-bromo-N-(2-butoxyethyl)-2-hydrazinylpyridine-3-carboxamide
CID 62242770
5-bromo-2-hydrazinyl-N-(3-methoxypropyl)pyridine-3-carboxamide
CID 62242203
5-bromo-2-hydrazinyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]pyridine-3-carboxamide
CID 63832210
5-bromo-2-hydrazinyl-N-(3-methylbutyl)pyridine-3-carboxamide
CID 62237644
5-bromo-N-[2-[cyclopropyl(methyl)amino]ethyl]-2-hydrazinylpyridine-3-carboxamide
CID 62979826
3,5-dibromo-N-(2-cyclopentyloxyethyl)benzamide
CID 103908078
5-bromo-N-(1-cyclohexylethyl)-2-hydrazinylpyridine-3-carboxamide
CID 62406728
5-bromo-2-hydrazinyl-N-(4,4,4-trifluorobutyl)pyridine-3-carboxamide
CID 113328075
2-bromo-N-(2-cyclohexyloxyethyl)pyridine-4-carboxamide
CID 113255607
2-bromo-N-(2-cyclopentyloxyethyl)benzamide
CID 55151515
N-(2-cyclohexyloxyethyl)-2,3-difluoropyridine-4-carboxamide
CID 105381247
4-bromo-N-(2-cyclopentyloxyethyl)benzamide
CID 61149535

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(2-cyclohexyloxyethyl)-2-hydrazinylpyridine-3-carboxamide?
The IUPAC name of 5-bromo-N-(2-cyclohexyloxyethyl)-2-hydrazinylpyridine-3-carboxamide (CID 63833624) is 5-bromo-N-(2-cyclohexyloxyethyl)-2-hydrazinylpyridine-3-carboxamide.
What is the SMILES notation for 5-bromo-N-(2-cyclohexyloxyethyl)-2-hydrazinylpyridine-3-carboxamide?
The canonical SMILES for 5-bromo-N-(2-cyclohexyloxyethyl)-2-hydrazinylpyridine-3-carboxamide is NNc1ncc(Br)cc1C(=O)NCCOC1CCCCC1.
What is the InChIKey of 5-bromo-N-(2-cyclohexyloxyethyl)-2-hydrazinylpyridine-3-carboxamide?
The InChIKey is KGHBWCOKVSJHQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21BrN4O2/c15-10-8-12(13(19-16)18-9-10)14(20)17-6-7-21-11-4-2-1-3-5-11/h8-9,11H,1-7,16H2,(H,17,20)(H,18,19).
What are the key properties of 5-bromo-N-(2-cyclohexyloxyethyl)-2-hydrazinylpyridine-3-carboxamide?
5-bromo-N-(2-cyclohexyloxyethyl)-2-hydrazinylpyridine-3-carboxamide has a molecular weight of 357.25 g/mol, XLogP of 2.21, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(2-cyclohexyloxyethyl)-2-hydrazinylpyridine-3-carboxamide is sourced from PubChem (CID 63833624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).