1-(2,4-dibromophenyl)-1-(4-methoxyphenyl)-N-methylmethanamine

C15H15Br2NO — CID 107945123

IUPAC1-(2,4-dibromophenyl)-1-(4-methoxyphenyl)-N-methylmethanamine
SMILESCNC(c1ccc(OC)cc1)c1ccc(Br)cc1Br
InChIInChI=1S/C15H15Br2NO/c1-18-15(10-3-6-12(19-2)7-4-10)13-8-5-11(16)9-14(13)17/h3-9,15,18H,1-2H3
InChIKeyHLBWRLRTBCLKFL-UHFFFAOYSA-N
MW385.10 g/mol
LogP4.53
Rot. Bonds4

About 1-(2,4-dibromophenyl)-1-(4-methoxyphenyl)-N-methylmethanamine

1-(2,4-dibromophenyl)-1-(4-methoxyphenyl)-N-methylmethanamine (PubChem CID 107945123) has the molecular formula C15H15Br2NO and a molecular weight of 385.10 g/mol. Its IUPAC name is 1-(2,4-dibromophenyl)-1-(4-methoxyphenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(2,4-dibromophenyl)-1-(4-methoxyphenyl)-N-methylmethanamine
PubChem CID107945123
Molecular FormulaC15H15Br2NO
Molecular Weight385.10 g/mol
Exact Mass382.95
IUPAC Name1-(2,4-dibromophenyl)-1-(4-methoxyphenyl)-N-methylmethanamine
SMILESCNC(c1ccc(OC)cc1)c1ccc(Br)cc1Br
InChIInChI=1S/C15H15Br2NO/c1-18-15(10-3-6-12(19-2)7-4-10)13-8-5-11(16)9-14(13)17/h3-9,15,18H,1-2H3
InChIKeyHLBWRLRTBCLKFL-UHFFFAOYSA-N
XLogP4.53
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.10
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-bromo-4-methoxyphenyl)-1-(4-ethoxyphenyl)-N-methylmethanamine
CID 60786122
1-(2,4-dibromophenyl)-1-(4-fluorophenyl)-N-methylmethanamine
CID 107945033
1-(2-bromo-5-methoxyphenyl)-1-(4-methoxyphenyl)-N-methylmethanamine
CID 105095539
1-(2,4-dibromophenyl)-N-methyl-1-(4-propylphenyl)methanamine
CID 107945722
1-(2,4-dibromophenyl)-1-(3,5-dimethoxypyrazin-2-yl)-N-methylmethanamine
CID 107946646
1-(5-bromo-2-methoxy-4-methylphenyl)-1-(4-methoxyphenyl)-N-methylmethanamine
CID 65438765
1-(2-bromo-5-methoxyphenyl)-N-methyl-1-(4-methylphenyl)methanamine
CID 105092588
1-(3-bromo-4-chlorophenyl)-1-(2-chloro-4-methoxyphenyl)-N-methylmethanamine
CID 107998666
1-(4-bromophenyl)-1-(3,5-dimethoxyphenyl)-N-methylmethanamine
CID 43481084
1-(3-bromo-4-chlorophenyl)-1-(4-methoxyphenyl)-N-methylmethanamine
CID 115567230
1-(4-bromo-3-chlorophenyl)-1-(4-methoxyphenyl)-N-methylmethanamine
CID 81290742
1-(5-bromofuran-2-yl)-1-(2-bromo-4-methoxyphenyl)-N-methylmethanamine
CID 60787977

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dibromophenyl)-1-(4-methoxyphenyl)-N-methylmethanamine?
The IUPAC name of 1-(2,4-dibromophenyl)-1-(4-methoxyphenyl)-N-methylmethanamine (CID 107945123) is 1-(2,4-dibromophenyl)-1-(4-methoxyphenyl)-N-methylmethanamine.
What is the SMILES notation for 1-(2,4-dibromophenyl)-1-(4-methoxyphenyl)-N-methylmethanamine?
The canonical SMILES for 1-(2,4-dibromophenyl)-1-(4-methoxyphenyl)-N-methylmethanamine is CNC(c1ccc(OC)cc1)c1ccc(Br)cc1Br.
What is the InChIKey of 1-(2,4-dibromophenyl)-1-(4-methoxyphenyl)-N-methylmethanamine?
The InChIKey is HLBWRLRTBCLKFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15Br2NO/c1-18-15(10-3-6-12(19-2)7-4-10)13-8-5-11(16)9-14(13)17/h3-9,15,18H,1-2H3.
What are the key properties of 1-(2,4-dibromophenyl)-1-(4-methoxyphenyl)-N-methylmethanamine?
1-(2,4-dibromophenyl)-1-(4-methoxyphenyl)-N-methylmethanamine has a molecular weight of 385.10 g/mol, XLogP of 4.53, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dibromophenyl)-1-(4-methoxyphenyl)-N-methylmethanamine is sourced from PubChem (CID 107945123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).