4-(aminomethyl)-6-bromopyridin-3-amine

C6H8BrN3 — CID 14518339

IUPAC4-(aminomethyl)-6-bromopyridin-3-amine
SMILESNCc1cc(Br)ncc1N
InChIInChI=1S/C6H8BrN3/c7-6-1-4(2-8)5(9)3-10-6/h1,3H,2,8-9H2
InChIKeyNJLNCJBDCPXTST-UHFFFAOYSA-N
MW202.06 g/mol
LogP0.88
Rot. Bonds1

About 4-(aminomethyl)-6-bromopyridin-3-amine

4-(aminomethyl)-6-bromopyridin-3-amine (PubChem CID 14518339) has the molecular formula C6H8BrN3 and a molecular weight of 202.06 g/mol. Its IUPAC name is 4-(aminomethyl)-6-bromopyridin-3-amine.

Molecular Properties

Compound Name4-(aminomethyl)-6-bromopyridin-3-amine
PubChem CID14518339
Molecular FormulaC6H8BrN3
Molecular Weight202.06 g/mol
Exact Mass200.99
IUPAC Name4-(aminomethyl)-6-bromopyridin-3-amine
SMILESNCc1cc(Br)ncc1N
InChIInChI=1S/C6H8BrN3/c7-6-1-4(2-8)5(9)3-10-6/h1,3H,2,8-9H2
InChIKeyNJLNCJBDCPXTST-UHFFFAOYSA-N
XLogP0.88
TPSA64.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.06
LogP ≤ 50.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-(aminomethyl)-2-bromopyridin-4-amine
CID 130115993
6-bromopyridine-3,4-diamine
CID 18788657
ethyl 2-(5-amino-2-bromo-4-pyridinyl)acetate
CID 133098456
6-bromo-4-N-methylpyridine-3,4-diamine
CID 86661976
(6-bromo-3-pyridinyl)methanamine
CID 22450529
(4-amino-6-bromo-3-pyridinyl) 2-aminoacetate
CID 175311143
3,7-dibromoisoquinolin-6-amine
CID 118577185
4-amino-6-bromopyridine-3-carbonitrile
CID 118811829
6-bromo-4-ethanimidoylpyridin-3-amine
CID 143774873
(6-bromo-1H-pyrazolo[5,4-b]pyridin-4-yl)methanamine
CID 133059794
ethyl 2-(2-bromo-5-methyl-4-pyridinyl)acetate
CID 133098009
5,11-dibromo-8-thia-4,12-diazatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaene
CID 155224076

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-6-bromopyridin-3-amine?
The IUPAC name of 4-(aminomethyl)-6-bromopyridin-3-amine (CID 14518339) is 4-(aminomethyl)-6-bromopyridin-3-amine.
What is the SMILES notation for 4-(aminomethyl)-6-bromopyridin-3-amine?
The canonical SMILES for 4-(aminomethyl)-6-bromopyridin-3-amine is NCc1cc(Br)ncc1N.
What is the InChIKey of 4-(aminomethyl)-6-bromopyridin-3-amine?
The InChIKey is NJLNCJBDCPXTST-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8BrN3/c7-6-1-4(2-8)5(9)3-10-6/h1,3H,2,8-9H2.
What are the key properties of 4-(aminomethyl)-6-bromopyridin-3-amine?
4-(aminomethyl)-6-bromopyridin-3-amine has a molecular weight of 202.06 g/mol, XLogP of 0.88, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-6-bromopyridin-3-amine is sourced from PubChem (CID 14518339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).