(3,5-dibromo-2-pyridinyl)methanamine;hydrochloride

C6H7Br2ClN2 — CID 133055680

IUPAC(3,5-dibromo-2-pyridinyl)methanamine;hydrochloride
SMILESCl.NCc1ncc(Br)cc1Br
InChIInChI=1S/C6H6Br2N2.ClH/c7-4-1-5(8)6(2-9)10-3-4;/h1,3H,2,9H2;1H
InChIKeyAYFPFQZRMNNOHV-UHFFFAOYSA-N
MW302.40 g/mol
LogP2.49
Rot. Bonds1

About (3,5-dibromo-2-pyridinyl)methanamine;hydrochloride

(3,5-dibromo-2-pyridinyl)methanamine;hydrochloride (PubChem CID 133055680) has the molecular formula C6H7Br2ClN2 and a molecular weight of 302.40 g/mol. Its IUPAC name is (3,5-dibromo-2-pyridinyl)methanamine;hydrochloride.

Molecular Properties

Compound Name(3,5-dibromo-2-pyridinyl)methanamine;hydrochloride
PubChem CID133055680
Molecular FormulaC6H7Br2ClN2
Molecular Weight302.40 g/mol
Exact Mass299.87
IUPAC Name(3,5-dibromo-2-pyridinyl)methanamine;hydrochloride
SMILESCl.NCc1ncc(Br)cc1Br
InChIInChI=1S/C6H6Br2N2.ClH/c7-4-1-5(8)6(2-9)10-3-4;/h1,3H,2,9H2;1H
InChIKeyAYFPFQZRMNNOHV-UHFFFAOYSA-N
XLogP2.49
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.40
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-(aminomethyl)-5-bromopyridin-3-ol
CID 133055152
3,5-dibromo-2-(fluoromethyl)pyridine
CID 149128897
2-(aminomethyl)-5-bromopyridine-3-carboxylic acid
CID 165451398
[5-bromo-3-(3,5-dimethylphenoxy)-2-pyridinyl]methanamine
CID 114202920
N-[(3,5-dibromo-2-pyridinyl)methyl]-1-pyridin-2-ylmethanamine
CID 113393640
(3aR,6aS)-5-[(3,5-dibromo-2-pyridinyl)methyl]-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole;hydrochloride
CID 120660850
1-[[(3,5-dibromo-2-pyridinyl)methylamino]methyl]cyclopentan-1-ol
CID 113393726
[1-[(3,5-dibromo-2-pyridinyl)methyl]-3-methylpyrrolidin-3-yl]methanamine
CID 120781080
(6,8-dibromoisoquinolin-1-yl)methanamine
CID 125426485
[1-[(3,5-dibromo-2-pyridinyl)methyl]-4-methylpiperidin-2-yl]methanamine
CID 103440485
6-[(3,5-dibromo-2-pyridinyl)methylamino]hexan-1-ol
CID 104573881
tert-butyl 2-(3,5-dibromo-2-pyridinyl)acetate
CID 133061246

Frequently Asked Questions

What is the IUPAC name of (3,5-dibromo-2-pyridinyl)methanamine;hydrochloride?
The IUPAC name of (3,5-dibromo-2-pyridinyl)methanamine;hydrochloride (CID 133055680) is (3,5-dibromo-2-pyridinyl)methanamine;hydrochloride.
What is the SMILES notation for (3,5-dibromo-2-pyridinyl)methanamine;hydrochloride?
The canonical SMILES for (3,5-dibromo-2-pyridinyl)methanamine;hydrochloride is Cl.NCc1ncc(Br)cc1Br.
What is the InChIKey of (3,5-dibromo-2-pyridinyl)methanamine;hydrochloride?
The InChIKey is AYFPFQZRMNNOHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6Br2N2.ClH/c7-4-1-5(8)6(2-9)10-3-4;/h1,3H,2,9H2;1H.
What are the key properties of (3,5-dibromo-2-pyridinyl)methanamine;hydrochloride?
(3,5-dibromo-2-pyridinyl)methanamine;hydrochloride has a molecular weight of 302.40 g/mol, XLogP of 2.49, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dibromo-2-pyridinyl)methanamine;hydrochloride is sourced from PubChem (CID 133055680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).