5-bromo-2-hydrazinyl-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide

C14H15BrN4O2 — CID 62236794

IUPAC5-bromo-2-hydrazinyl-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide
SMILESNNc1ncc(Br)cc1C(=O)Nc1ccc(CCO)cc1
InChIInChI=1S/C14H15BrN4O2/c15-10-7-12(13(19-16)17-8-10)14(21)18-11-3-1-9(2-4-11)5-6-20/h1-4,7-8,20H,5-6,16H2,(H,17,19)(H,18,21)
InChIKeyCCBDNRJNSQVLBJ-UHFFFAOYSA-N
MW351.20 g/mol
LogP1.92
Rot. Bonds5

About 5-bromo-2-hydrazinyl-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide

5-bromo-2-hydrazinyl-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide (PubChem CID 62236794) has the molecular formula C14H15BrN4O2 and a molecular weight of 351.20 g/mol. Its IUPAC name is 5-bromo-2-hydrazinyl-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-bromo-2-hydrazinyl-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide
PubChem CID62236794
Molecular FormulaC14H15BrN4O2
Molecular Weight351.20 g/mol
Exact Mass350.04
IUPAC Name5-bromo-2-hydrazinyl-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide
SMILESNNc1ncc(Br)cc1C(=O)Nc1ccc(CCO)cc1
InChIInChI=1S/C14H15BrN4O2/c15-10-7-12(13(19-16)17-8-10)14(21)18-11-3-1-9(2-4-11)5-6-20/h1-4,7-8,20H,5-6,16H2,(H,17,19)(H,18,21)
InChIKeyCCBDNRJNSQVLBJ-UHFFFAOYSA-N
XLogP1.92
TPSA100.27 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.20
LogP ≤ 51.92
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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-(4-cyanophenyl)-2-hydrazinylpyridine-3-carboxamide
CID 62249046
5-hydrazinyl-N-[4-(2-hydroxyethyl)phenyl]pyridine-2-carboxamide
CID 104642279
5-bromo-N-(5-bromo-3-methyl-2-pyridinyl)-2-hydrazinylpyridine-3-carboxamide
CID 83170019
5-bromo-2-hydrazinyl-N-(3-phenylpropyl)pyridine-3-carboxamide
CID 62238180
5-bromo-2-hydrazinyl-N-[(4-methylphenyl)methyl]pyridine-3-carboxamide
CID 62248877
5-bromo-N-(2,6-dichlorophenyl)-2-hydrazinylpyridine-3-carboxamide
CID 65498887
5-bromo-2-(ethylamino)-N-(4-fluorophenyl)pyridine-3-carboxamide
CID 62167609
5-bromo-N-(2-ethoxyphenyl)-2-hydrazinylpyridine-3-carboxamide
CID 62236676
5-bromo-N-tert-butyl-2-hydrazinylpyridine-3-carboxamide
CID 62238273
3,6-dichloro-N-[4-(2-hydroxyethyl)phenyl]pyridazine-4-carboxamide
CID 61221964
5-bromo-N-(2-fluoro-5-methylphenyl)-2-hydrazinylpyridine-3-carboxamide
CID 62242736
5-bromo-N-(2-bromo-4,6-difluorophenyl)-2-hydrazinylpyridine-3-carboxamide
CID 62243354

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-hydrazinyl-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide?
The IUPAC name of 5-bromo-2-hydrazinyl-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide (CID 62236794) is 5-bromo-2-hydrazinyl-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide.
What is the SMILES notation for 5-bromo-2-hydrazinyl-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide?
The canonical SMILES for 5-bromo-2-hydrazinyl-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide is NNc1ncc(Br)cc1C(=O)Nc1ccc(CCO)cc1.
What is the InChIKey of 5-bromo-2-hydrazinyl-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide?
The InChIKey is CCBDNRJNSQVLBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15BrN4O2/c15-10-7-12(13(19-16)17-8-10)14(21)18-11-3-1-9(2-4-11)5-6-20/h1-4,7-8,20H,5-6,16H2,(H,17,19)(H,18,21).
What are the key properties of 5-bromo-2-hydrazinyl-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide?
5-bromo-2-hydrazinyl-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide has a molecular weight of 351.20 g/mol, XLogP of 1.92, 5 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-hydrazinyl-N-[4-(2-hydroxyethyl)phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 62236794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).