5-bromo-3-chloropyridin-2-amine;3-chloropyridin-2-amine

C10H9BrCl2N4 — CID 160785204

IUPAC5-bromo-3-chloropyridin-2-amine;3-chloropyridin-2-amine
SMILESNc1ncc(Br)cc1Cl.Nc1ncccc1Cl
InChIInChI=1S/C5H4BrClN2.C5H5ClN2/c6-3-1-4(7)5(8)9-2-3;6-4-2-1-3-8-5(4)7/h1-2H,(H2,8,9);1-3H,(H2,7,8)
InChIKeySBCMTBPNDKLKHD-UHFFFAOYSA-N
MW336.02 g/mol
LogP3.40
Rot. Bonds

About 5-bromo-3-chloropyridin-2-amine;3-chloropyridin-2-amine

5-bromo-3-chloropyridin-2-amine;3-chloropyridin-2-amine (PubChem CID 160785204) has the molecular formula C10H9BrCl2N4 and a molecular weight of 336.02 g/mol. Its IUPAC name is 5-bromo-3-chloropyridin-2-amine;3-chloropyridin-2-amine.

Molecular Properties

Compound Name5-bromo-3-chloropyridin-2-amine;3-chloropyridin-2-amine
PubChem CID160785204
Molecular FormulaC10H9BrCl2N4
Molecular Weight336.02 g/mol
Exact Mass333.94
IUPAC Name5-bromo-3-chloropyridin-2-amine;3-chloropyridin-2-amine
SMILESNc1ncc(Br)cc1Cl.Nc1ncccc1Cl
InChIInChI=1S/C5H4BrClN2.C5H5ClN2/c6-3-1-4(7)5(8)9-2-3;6-4-2-1-3-8-5(4)7/h1-2H,(H2,8,9);1-3H,(H2,7,8)
InChIKeySBCMTBPNDKLKHD-UHFFFAOYSA-N
XLogP3.40
TPSA77.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.02
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-Amino-5-bromopyridine
CID 70622
2-Amino-5-chloropyridine
CID 66174
2-Amino-5-bromo-4-chloropyridine
CID 44181812
2-Amino-3-chloropyridine
CID 693267
3,5-dichloro-N-[(E)-pyridin-4-ylmethylideneamino]pyridin-2-amine
CID 9642027
1,3-Bis(5-chloropyridin-2-yl)urea
CID 1077773
2-Amino-3-bromopyridine
CID 817700
3-Bromo-5-chloropyridin-2-amine
CID 2763971
1,4-Bis(3-chloro-2-pyridinyl)piperazine;hydrochloride
CID 44523131
N-(5-Bromo-pyridin-2-yl)-guanidine
CID 10262708
N-(3,5-Dichloro-pyridin-2-yl)-guanidine
CID 44297829
N-(5-Chloro-pyridin-2-yl)-guanidine
CID 44297850

Frequently Asked Questions

What is the IUPAC name of 5-bromo-3-chloropyridin-2-amine;3-chloropyridin-2-amine?
The IUPAC name of 5-bromo-3-chloropyridin-2-amine;3-chloropyridin-2-amine (CID 160785204) is 5-bromo-3-chloropyridin-2-amine;3-chloropyridin-2-amine.
What is the SMILES notation for 5-bromo-3-chloropyridin-2-amine;3-chloropyridin-2-amine?
The canonical SMILES for 5-bromo-3-chloropyridin-2-amine;3-chloropyridin-2-amine is Nc1ncc(Br)cc1Cl.Nc1ncccc1Cl.
What is the InChIKey of 5-bromo-3-chloropyridin-2-amine;3-chloropyridin-2-amine?
The InChIKey is SBCMTBPNDKLKHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4BrClN2.C5H5ClN2/c6-3-1-4(7)5(8)9-2-3;6-4-2-1-3-8-5(4)7/h1-2H,(H2,8,9);1-3H,(H2,7,8).
What are the key properties of 5-bromo-3-chloropyridin-2-amine;3-chloropyridin-2-amine?
5-bromo-3-chloropyridin-2-amine;3-chloropyridin-2-amine has a molecular weight of 336.02 g/mol, XLogP of 3.40, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3-chloropyridin-2-amine;3-chloropyridin-2-amine is sourced from PubChem (CID 160785204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).