5-bromo-N'-(4-bromo-1H-pyrrole-2-carbonyl)pyridine-3-carbohydrazide

C11H8Br2N4O2 — CID 9255864

IUPAC5-bromo-N'-(4-bromo-1H-pyrrole-2-carbonyl)pyridine-3-carbohydrazide
SMILESO=C(NNC(=O)c1cc(Br)c[nH]1)c1cncc(Br)c1
InChIInChI=1S/C11H8Br2N4O2/c12-7-1-6(3-14-4-7)10(18)16-17-11(19)9-2-8(13)5-15-9/h1-5,15H,(H,16,18)(H,17,19)
InChIKeyNMWMXYNHKITZRN-UHFFFAOYSA-N
MW388.02 g/mol
LogP2.01
Rot. Bonds2

About 5-bromo-N'-(4-bromo-1H-pyrrole-2-carbonyl)pyridine-3-carbohydrazide

5-bromo-N'-(4-bromo-1H-pyrrole-2-carbonyl)pyridine-3-carbohydrazide (PubChem CID 9255864) has the molecular formula C11H8Br2N4O2 and a molecular weight of 388.02 g/mol. Its IUPAC name is 5-bromo-N'-(4-bromo-1H-pyrrole-2-carbonyl)pyridine-3-carbohydrazide.

Molecular Properties

Compound Name5-bromo-N'-(4-bromo-1H-pyrrole-2-carbonyl)pyridine-3-carbohydrazide
PubChem CID9255864
Molecular FormulaC11H8Br2N4O2
Molecular Weight388.02 g/mol
Exact Mass385.90
IUPAC Name5-bromo-N'-(4-bromo-1H-pyrrole-2-carbonyl)pyridine-3-carbohydrazide
SMILESO=C(NNC(=O)c1cc(Br)c[nH]1)c1cncc(Br)c1
InChIInChI=1S/C11H8Br2N4O2/c12-7-1-6(3-14-4-7)10(18)16-17-11(19)9-2-8(13)5-15-9/h1-5,15H,(H,16,18)(H,17,19)
InChIKeyNMWMXYNHKITZRN-UHFFFAOYSA-N
XLogP2.01
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.02
LogP ≤ 52.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-benzoyl-5-bromopyridine-3-carbohydrazide
CID 40613239
4-bromo-N'-(3,4-dimethylbenzoyl)-1H-pyrrole-2-carbohydrazide
CID 9255934
N'-(4-bromo-1H-pyrrole-2-carbonyl)-6-methoxypyridine-3-carbohydrazide
CID 39447654
4-bromo-N'-(3-iodobenzoyl)-1H-pyrrole-2-carbohydrazide
CID 31421335
bis(5-bromo-3-pyridinyl)methanone
CID 150630113
4-bromo-N'-[3-ethoxy-4-(pyridin-4-ylmethoxy)benzoyl]-1H-pyrrole-2-carbohydrazide
CID 39641079
4-[[(4-bromo-1H-pyrrole-2-carbonyl)amino]carbamoyl]-N,N-dimethylbenzenesulfonamide
CID 31421387
N'-(4-bromo-1H-pyrrole-2-carbonyl)-3-methyl-1,2-oxazole-5-carbohydrazide
CID 31598667
4-bromo-N'-(3-methylbutanoyl)-1H-pyrrole-2-carbohydrazide
CID 18121265
N-[4-[[(4-bromo-1H-pyrrole-2-carbonyl)amino]carbamoyl]phenyl]cyclopropanecarboxamide
CID 31421628
5-bromo-N-methoxypyridine-3-carboxamide
CID 51279281
5-bromo-N-(3-hydroxybutan-2-yl)pyridine-3-carboxamide
CID 131048375

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N'-(4-bromo-1H-pyrrole-2-carbonyl)pyridine-3-carbohydrazide?
The IUPAC name of 5-bromo-N'-(4-bromo-1H-pyrrole-2-carbonyl)pyridine-3-carbohydrazide (CID 9255864) is 5-bromo-N'-(4-bromo-1H-pyrrole-2-carbonyl)pyridine-3-carbohydrazide.
What is the SMILES notation for 5-bromo-N'-(4-bromo-1H-pyrrole-2-carbonyl)pyridine-3-carbohydrazide?
The canonical SMILES for 5-bromo-N'-(4-bromo-1H-pyrrole-2-carbonyl)pyridine-3-carbohydrazide is O=C(NNC(=O)c1cc(Br)c[nH]1)c1cncc(Br)c1.
What is the InChIKey of 5-bromo-N'-(4-bromo-1H-pyrrole-2-carbonyl)pyridine-3-carbohydrazide?
The InChIKey is NMWMXYNHKITZRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8Br2N4O2/c12-7-1-6(3-14-4-7)10(18)16-17-11(19)9-2-8(13)5-15-9/h1-5,15H,(H,16,18)(H,17,19).
What are the key properties of 5-bromo-N'-(4-bromo-1H-pyrrole-2-carbonyl)pyridine-3-carbohydrazide?
5-bromo-N'-(4-bromo-1H-pyrrole-2-carbonyl)pyridine-3-carbohydrazide has a molecular weight of 388.02 g/mol, XLogP of 2.01, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N'-(4-bromo-1H-pyrrole-2-carbonyl)pyridine-3-carbohydrazide is sourced from PubChem (CID 9255864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).