N-bromo-2-iodopyridin-3-amine

C5H4BrIN2 — CID 91482689

IUPACN-bromo-2-iodopyridin-3-amine
SMILESBrNc1cccnc1I
InChIInChI=1S/C5H4BrIN2/c6-9-4-2-1-3-8-5(4)7/h1-3,9H
InChIKeyZDPZPGLOIIHAQP-UHFFFAOYSA-N
MW298.91 g/mol
LogP2.41
Rot. Bonds1

About N-bromo-2-iodopyridin-3-amine

N-bromo-2-iodopyridin-3-amine (PubChem CID 91482689) has the molecular formula C5H4BrIN2 and a molecular weight of 298.91 g/mol. Its IUPAC name is N-bromo-2-iodopyridin-3-amine.

Molecular Properties

Compound NameN-bromo-2-iodopyridin-3-amine
PubChem CID91482689
Molecular FormulaC5H4BrIN2
Molecular Weight298.91 g/mol
Exact Mass297.86
IUPAC NameN-bromo-2-iodopyridin-3-amine
SMILESBrNc1cccnc1I
InChIInChI=1S/C5H4BrIN2/c6-9-4-2-1-3-8-5(4)7/h1-3,9H
InChIKeyZDPZPGLOIIHAQP-UHFFFAOYSA-N
XLogP2.41
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.91
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'N-halo', 'substructure': 'N/A'}

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Related Compounds

2-iodo-3-propan-2-ylpyridine
CID 23436890
2-iodopyridin-3-ol;hydrochloride
CID 141441787
2-iodo-3-propan-2-ylsulfonylpyridine
CID 86669848
N-[1-(2-iodo-3-pyridinyl)ethyl]acetamide
CID 87649733
2-bromo-N-(1-methoxypropan-2-yl)pyridin-3-amine
CID 103744132
2-bromo-N-(2-chloro-3-pyridinyl)propanamide
CID 107903037
3-N-propan-2-ylpyridine-2,3-diamine
CID 58213244
2-iodo-3-pyridin-3-ylpyridine
CID 134338193
2-fluoro-N-methylpyridin-3-amine
CID 66665252
2,3-diiodopyrido[2,3-b]pyrazine
CID 163873901
3-fluoro-N-(4-iodo-3-pyridinyl)pyridin-2-amine
CID 170346573
2-chloro-N-(2-chloro-3-pyridinyl)benzamide
CID 4245221

Frequently Asked Questions

What is the IUPAC name of N-bromo-2-iodopyridin-3-amine?
The IUPAC name of N-bromo-2-iodopyridin-3-amine (CID 91482689) is N-bromo-2-iodopyridin-3-amine.
What is the SMILES notation for N-bromo-2-iodopyridin-3-amine?
The canonical SMILES for N-bromo-2-iodopyridin-3-amine is BrNc1cccnc1I.
What is the InChIKey of N-bromo-2-iodopyridin-3-amine?
The InChIKey is ZDPZPGLOIIHAQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4BrIN2/c6-9-4-2-1-3-8-5(4)7/h1-3,9H.
What are the key properties of N-bromo-2-iodopyridin-3-amine?
N-bromo-2-iodopyridin-3-amine has a molecular weight of 298.91 g/mol, XLogP of 2.41, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-bromo-2-iodopyridin-3-amine is sourced from PubChem (CID 91482689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).