1-[6-[(2-bromophenyl)methoxy]-2-methyl-3-pyridinyl]-N-methylmethanamine

C15H17BrN2O — CID 82832072

IUPAC1-[6-[(2-bromophenyl)methoxy]-2-methyl-3-pyridinyl]-N-methylmethanamine
SMILESCNCc1ccc(OCc2ccccc2Br)nc1C
InChIInChI=1S/C15H17BrN2O/c1-11-12(9-17-2)7-8-15(18-11)19-10-13-5-3-4-6-14(13)16/h3-8,17H,9-10H2,1-2H3
InChIKeySACFZCTWXHLZFZ-UHFFFAOYSA-N
MW321.22 g/mol
LogP3.45
Rot. Bonds5

About 1-[6-[(2-bromophenyl)methoxy]-2-methyl-3-pyridinyl]-N-methylmethanamine

1-[6-[(2-bromophenyl)methoxy]-2-methyl-3-pyridinyl]-N-methylmethanamine (PubChem CID 82832072) has the molecular formula C15H17BrN2O and a molecular weight of 321.22 g/mol. Its IUPAC name is 1-[6-[(2-bromophenyl)methoxy]-2-methyl-3-pyridinyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[6-[(2-bromophenyl)methoxy]-2-methyl-3-pyridinyl]-N-methylmethanamine
PubChem CID82832072
Molecular FormulaC15H17BrN2O
Molecular Weight321.22 g/mol
Exact Mass320.05
IUPAC Name1-[6-[(2-bromophenyl)methoxy]-2-methyl-3-pyridinyl]-N-methylmethanamine
SMILESCNCc1ccc(OCc2ccccc2Br)nc1C
InChIInChI=1S/C15H17BrN2O/c1-11-12(9-17-2)7-8-15(18-11)19-10-13-5-3-4-6-14(13)16/h3-8,17H,9-10H2,1-2H3
InChIKeySACFZCTWXHLZFZ-UHFFFAOYSA-N
XLogP3.45
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.22
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-[(2-bromophenyl)methoxy]-3-pyridinyl]-N-methylmethanamine
CID 82831764
N-methyl-1-[2-[(5-methyl-1H-pyrazol-3-yl)oxymethyl]phenyl]methanamine
CID 81341305
1-[3,5-dibromo-4-[(2-bromophenyl)methoxy]phenyl]-N-methylmethanamine
CID 107741910
6-[(2-bromophenyl)methoxy]pyridine-2-carbonitrile
CID 82825869
5-bromo-2-[(2-bromophenyl)methoxy]pyridine
CID 82832179
[6-[(2-bromophenyl)methoxy]-2-pyridinyl]methanamine
CID 82828361
N-[[6-[(2-bromophenyl)methoxy]-2-pyridinyl]methyl]-2-methylpropan-1-amine
CID 82807232
1-[2-[(2-bromophenyl)methoxy]-5-methoxyphenyl]-N-methylmethanamine
CID 60880406
N-[[6-[(4-bromophenyl)methoxy]-2-methyl-3-pyridinyl]methyl]ethanamine
CID 82832289
N-[[6-[(2-bromophenyl)methoxy]pyridazin-3-yl]methyl]ethanamine
CID 82831544
2-[(2-bromophenyl)methoxy]pyridine
CID 24799165
1-[2-[2-(2-bromophenoxy)ethoxy]phenyl]-N-methylmethanamine
CID 62450311

Frequently Asked Questions

What is the IUPAC name of 1-[6-[(2-bromophenyl)methoxy]-2-methyl-3-pyridinyl]-N-methylmethanamine?
The IUPAC name of 1-[6-[(2-bromophenyl)methoxy]-2-methyl-3-pyridinyl]-N-methylmethanamine (CID 82832072) is 1-[6-[(2-bromophenyl)methoxy]-2-methyl-3-pyridinyl]-N-methylmethanamine.
What is the SMILES notation for 1-[6-[(2-bromophenyl)methoxy]-2-methyl-3-pyridinyl]-N-methylmethanamine?
The canonical SMILES for 1-[6-[(2-bromophenyl)methoxy]-2-methyl-3-pyridinyl]-N-methylmethanamine is CNCc1ccc(OCc2ccccc2Br)nc1C.
What is the InChIKey of 1-[6-[(2-bromophenyl)methoxy]-2-methyl-3-pyridinyl]-N-methylmethanamine?
The InChIKey is SACFZCTWXHLZFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17BrN2O/c1-11-12(9-17-2)7-8-15(18-11)19-10-13-5-3-4-6-14(13)16/h3-8,17H,9-10H2,1-2H3.
What are the key properties of 1-[6-[(2-bromophenyl)methoxy]-2-methyl-3-pyridinyl]-N-methylmethanamine?
1-[6-[(2-bromophenyl)methoxy]-2-methyl-3-pyridinyl]-N-methylmethanamine has a molecular weight of 321.22 g/mol, XLogP of 3.45, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-[(2-bromophenyl)methoxy]-2-methyl-3-pyridinyl]-N-methylmethanamine is sourced from PubChem (CID 82832072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).