5-bromo-3-chloro-1,2-dihydropyridin-6-amine

C5H6BrClN2 — CID 174278122

IUPAC5-bromo-3-chloro-1,2-dihydropyridin-6-amine
SMILESNC1=C(Br)C=C(Cl)CN1
InChIInChI=1S/C5H6BrClN2/c6-4-1-3(7)2-9-5(4)8/h1,9H,2,8H2
InChIKeyFCPJASQVRBZCDL-UHFFFAOYSA-N
MW209.47 g/mol
LogP1.24
Rot. Bonds

About 5-bromo-3-chloro-1,2-dihydropyridin-6-amine

5-bromo-3-chloro-1,2-dihydropyridin-6-amine (PubChem CID 174278122) has the molecular formula C5H6BrClN2 and a molecular weight of 209.47 g/mol. Its IUPAC name is 5-bromo-3-chloro-1,2-dihydropyridin-6-amine.

Molecular Properties

Compound Name5-bromo-3-chloro-1,2-dihydropyridin-6-amine
PubChem CID174278122
Molecular FormulaC5H6BrClN2
Molecular Weight209.47 g/mol
Exact Mass207.94
IUPAC Name5-bromo-3-chloro-1,2-dihydropyridin-6-amine
SMILESNC1=C(Br)C=C(Cl)CN1
InChIInChI=1S/C5H6BrClN2/c6-4-1-3(7)2-9-5(4)8/h1,9H,2,8H2
InChIKeyFCPJASQVRBZCDL-UHFFFAOYSA-N
XLogP1.24
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.47
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-Bromo-3-chloro-6-fluoro-1,2-dihydropyridine
CID 171049279
3-Bromo-5-chloro-1,2-dihydropyridin-2-amine
CID 60100899
2-bromo-5-chloro-1H-pyridin-2-amine
CID 68600555
2-(Aminodiazenyl)-5-bromo-3-chloro-1,2-dihydropyridine
CID 131970352
5-Bromo-3-chloro-1,2-dihydropyridin-2-amine
CID 131970510
3-Chloro-1,2-dihydropyridin-6-amine
CID 144800062
5-bromo-2-chloro-1H-pyridin-2-amine
CID 152587519

Frequently Asked Questions

What is the IUPAC name of 5-bromo-3-chloro-1,2-dihydropyridin-6-amine?
The IUPAC name of 5-bromo-3-chloro-1,2-dihydropyridin-6-amine (CID 174278122) is 5-bromo-3-chloro-1,2-dihydropyridin-6-amine.
What is the SMILES notation for 5-bromo-3-chloro-1,2-dihydropyridin-6-amine?
The canonical SMILES for 5-bromo-3-chloro-1,2-dihydropyridin-6-amine is NC1=C(Br)C=C(Cl)CN1.
What is the InChIKey of 5-bromo-3-chloro-1,2-dihydropyridin-6-amine?
The InChIKey is FCPJASQVRBZCDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6BrClN2/c6-4-1-3(7)2-9-5(4)8/h1,9H,2,8H2.
What are the key properties of 5-bromo-3-chloro-1,2-dihydropyridin-6-amine?
5-bromo-3-chloro-1,2-dihydropyridin-6-amine has a molecular weight of 209.47 g/mol, XLogP of 1.24, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3-chloro-1,2-dihydropyridin-6-amine is sourced from PubChem (CID 174278122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).