6-[(5-bromo-3-pyridinyl)oxymethyl]-N-methylpyridin-2-amine

C12H12BrN3O — CID 79239382

IUPAC6-[(5-bromo-3-pyridinyl)oxymethyl]-N-methylpyridin-2-amine
SMILESCNc1cccc(COc2cncc(Br)c2)n1
InChIInChI=1S/C12H12BrN3O/c1-14-12-4-2-3-10(16-12)8-17-11-5-9(13)6-15-7-11/h2-7H,8H2,1H3,(H,14,16)
InChIKeyOYGLHAVITQJJQW-UHFFFAOYSA-N
MW294.15 g/mol
LogP2.86
Rot. Bonds4

About 6-[(5-bromo-3-pyridinyl)oxymethyl]-N-methylpyridin-2-amine

6-[(5-bromo-3-pyridinyl)oxymethyl]-N-methylpyridin-2-amine (PubChem CID 79239382) has the molecular formula C12H12BrN3O and a molecular weight of 294.15 g/mol. Its IUPAC name is 6-[(5-bromo-3-pyridinyl)oxymethyl]-N-methylpyridin-2-amine.

Molecular Properties

Compound Name6-[(5-bromo-3-pyridinyl)oxymethyl]-N-methylpyridin-2-amine
PubChem CID79239382
Molecular FormulaC12H12BrN3O
Molecular Weight294.15 g/mol
Exact Mass293.02
IUPAC Name6-[(5-bromo-3-pyridinyl)oxymethyl]-N-methylpyridin-2-amine
SMILESCNc1cccc(COc2cncc(Br)c2)n1
InChIInChI=1S/C12H12BrN3O/c1-14-12-4-2-3-10(16-12)8-17-11-5-9(13)6-15-7-11/h2-7H,8H2,1H3,(H,14,16)
InChIKeyOYGLHAVITQJJQW-UHFFFAOYSA-N
XLogP2.86
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.15
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-[(3-bromophenoxy)methyl]-N-methylpyridin-2-amine
CID 79239184
2-[(5-bromo-3-pyridinyl)oxymethyl]-6-methylpyridine
CID 79267890
N-[[6-[(5-bromo-3-pyridinyl)oxymethyl]-2-pyridinyl]methyl]propan-2-amine
CID 106908394
N-[[6-[(5-bromo-3-pyridinyl)oxymethyl]-2-pyridinyl]methyl]cyclopropanamine
CID 106908393
3-[[6-(methylamino)-2-pyridinyl]methoxy]benzonitrile
CID 79240035
3-bromo-5-phenylmethoxypyridine
CID 15389198
N-methyl-6-[(3-methyl-4-propan-2-ylphenoxy)methyl]pyridin-2-amine
CID 79239350
6-[(4-butan-2-ylphenoxy)methyl]-N-methylpyridin-2-amine
CID 107668066
2-[(5-bromo-3-pyridinyl)oxymethyl]-N-ethylpyridin-4-amine
CID 79259695
6-[(2-iodophenoxy)methyl]-N-methylpyridin-2-amine
CID 79239369
[6-[(6-bromonaphthalen-2-yl)oxymethyl]-2-pyridinyl]hydrazine
CID 79232593
1-[5-[(5-bromo-3-pyridinyl)oxymethyl]thiophen-2-yl]-N-methylmethanamine
CID 107558966

Frequently Asked Questions

What is the IUPAC name of 6-[(5-bromo-3-pyridinyl)oxymethyl]-N-methylpyridin-2-amine?
The IUPAC name of 6-[(5-bromo-3-pyridinyl)oxymethyl]-N-methylpyridin-2-amine (CID 79239382) is 6-[(5-bromo-3-pyridinyl)oxymethyl]-N-methylpyridin-2-amine.
What is the SMILES notation for 6-[(5-bromo-3-pyridinyl)oxymethyl]-N-methylpyridin-2-amine?
The canonical SMILES for 6-[(5-bromo-3-pyridinyl)oxymethyl]-N-methylpyridin-2-amine is CNc1cccc(COc2cncc(Br)c2)n1.
What is the InChIKey of 6-[(5-bromo-3-pyridinyl)oxymethyl]-N-methylpyridin-2-amine?
The InChIKey is OYGLHAVITQJJQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12BrN3O/c1-14-12-4-2-3-10(16-12)8-17-11-5-9(13)6-15-7-11/h2-7H,8H2,1H3,(H,14,16).
What are the key properties of 6-[(5-bromo-3-pyridinyl)oxymethyl]-N-methylpyridin-2-amine?
6-[(5-bromo-3-pyridinyl)oxymethyl]-N-methylpyridin-2-amine has a molecular weight of 294.15 g/mol, XLogP of 2.86, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(5-bromo-3-pyridinyl)oxymethyl]-N-methylpyridin-2-amine is sourced from PubChem (CID 79239382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).