6-bromo-4-methoxy-N,N-dimethylpyridin-2-amine

C8H11BrN2O — CID 133056820

IUPAC6-bromo-4-methoxy-N,N-dimethylpyridin-2-amine
SMILESCOc1cc(Br)nc(N(C)C)c1
InChIInChI=1S/C8H11BrN2O/c1-11(2)8-5-6(12-3)4-7(9)10-8/h4-5H,1-3H3
InChIKeyKFDXUCUHCCXHRD-UHFFFAOYSA-N
MW231.09 g/mol
LogP1.92
Rot. Bonds2

About 6-bromo-4-methoxy-N,N-dimethylpyridin-2-amine

6-bromo-4-methoxy-N,N-dimethylpyridin-2-amine (PubChem CID 133056820) has the molecular formula C8H11BrN2O and a molecular weight of 231.09 g/mol. Its IUPAC name is 6-bromo-4-methoxy-N,N-dimethylpyridin-2-amine.

Molecular Properties

Compound Name6-bromo-4-methoxy-N,N-dimethylpyridin-2-amine
PubChem CID133056820
Molecular FormulaC8H11BrN2O
Molecular Weight231.09 g/mol
Exact Mass230.01
IUPAC Name6-bromo-4-methoxy-N,N-dimethylpyridin-2-amine
SMILESCOc1cc(Br)nc(N(C)C)c1
InChIInChI=1S/C8H11BrN2O/c1-11(2)8-5-6(12-3)4-7(9)10-8/h4-5H,1-3H3
InChIKeyKFDXUCUHCCXHRD-UHFFFAOYSA-N
XLogP1.92
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.09
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2,6-dibromo-4-methoxypyridine
CID 10901569
6-bromo-4-methoxy-N-methylpyridin-2-amine
CID 133061275
6-bromo-N,N-dimethyl-4-(trifluoromethyl)pyridin-2-amine
CID 150570781
methyl 2-(6-bromo-4-methoxy-2-pyridinyl)acetate
CID 133098108
4-(benzenesulfonyl)-6-bromo-N,N-dimethylpyridin-2-amine
CID 15410399
6-bromo-N-[(3-methoxyphenyl)methyl]-N-methylpyridin-2-amine
CID 63962800
3-bromo-5-methoxypyridazine
CID 118497529
2-bromo-4-methoxy-6-phenylmethoxypyridine
CID 21471070
6-(2-bromo-4-methoxyphenoxy)-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 104708770
6-(3,5-dimethoxyphenoxy)-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 80867209
phosphane;1,3,5-trimethoxybenzene
CID 175232895
2,6-dibromo-4-methoxyaniline
CID 542895

Frequently Asked Questions

What is the IUPAC name of 6-bromo-4-methoxy-N,N-dimethylpyridin-2-amine?
The IUPAC name of 6-bromo-4-methoxy-N,N-dimethylpyridin-2-amine (CID 133056820) is 6-bromo-4-methoxy-N,N-dimethylpyridin-2-amine.
What is the SMILES notation for 6-bromo-4-methoxy-N,N-dimethylpyridin-2-amine?
The canonical SMILES for 6-bromo-4-methoxy-N,N-dimethylpyridin-2-amine is COc1cc(Br)nc(N(C)C)c1.
What is the InChIKey of 6-bromo-4-methoxy-N,N-dimethylpyridin-2-amine?
The InChIKey is KFDXUCUHCCXHRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11BrN2O/c1-11(2)8-5-6(12-3)4-7(9)10-8/h4-5H,1-3H3.
What are the key properties of 6-bromo-4-methoxy-N,N-dimethylpyridin-2-amine?
6-bromo-4-methoxy-N,N-dimethylpyridin-2-amine has a molecular weight of 231.09 g/mol, XLogP of 1.92, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-4-methoxy-N,N-dimethylpyridin-2-amine is sourced from PubChem (CID 133056820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).