1-(2-bromophenyl)-N-methyl-2-naphthalen-2-ylethanamine

C19H18BrN — CID 63529102

IUPAC1-(2-bromophenyl)-N-methyl-2-naphthalen-2-ylethanamine
SMILESCNC(Cc1ccc2ccccc2c1)c1ccccc1Br
InChIInChI=1S/C19H18BrN/c1-21-19(17-8-4-5-9-18(17)20)13-14-10-11-15-6-2-3-7-16(15)12-14/h2-12,19,21H,13H2,1H3
InChIKeyJWHYVUULOUIJPZ-UHFFFAOYSA-N
MW340.26 g/mol
LogP5.11
Rot. Bonds4

About 1-(2-bromophenyl)-N-methyl-2-naphthalen-2-ylethanamine

1-(2-bromophenyl)-N-methyl-2-naphthalen-2-ylethanamine (PubChem CID 63529102) has the molecular formula C19H18BrN and a molecular weight of 340.26 g/mol. Its IUPAC name is 1-(2-bromophenyl)-N-methyl-2-naphthalen-2-ylethanamine.

Molecular Properties

Compound Name1-(2-bromophenyl)-N-methyl-2-naphthalen-2-ylethanamine
PubChem CID63529102
Molecular FormulaC19H18BrN
Molecular Weight340.26 g/mol
Exact Mass339.06
IUPAC Name1-(2-bromophenyl)-N-methyl-2-naphthalen-2-ylethanamine
SMILESCNC(Cc1ccc2ccccc2c1)c1ccccc1Br
InChIInChI=1S/C19H18BrN/c1-21-19(17-8-4-5-9-18(17)20)13-14-10-11-15-6-2-3-7-16(15)12-14/h2-12,19,21H,13H2,1H3
InChIKeyJWHYVUULOUIJPZ-UHFFFAOYSA-N
XLogP5.11
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.26
LogP ≤ 55.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-fluorophenyl)-N-methyl-2-naphthalen-2-ylethanamine
CID 61078359
1-(2-bromophenyl)-2-(3-bromophenyl)-N-methylethanamine
CID 55185666
1-(2-bromophenyl)-2-(3-chloro-4-fluorophenyl)-N-methylethanamine
CID 103039915
1-(2-bromophenyl)-N-methyl-3-naphthalen-2-yloxypropan-1-amine;hydrochloride
CID 19884904
1-(4-iodophenyl)-N-methyl-2-naphthalen-2-ylethanamine
CID 63526847
1-(2-bromophenyl)-N-methyl-2-(4-nitrophenyl)ethanamine
CID 61064825
1-(3-iodophenyl)-N-methyl-2-naphthalen-2-ylethanamine
CID 63526846
1-(2-bromophenyl)-N,N'-dimethylethane-1,2-diamine
CID 116948009
(2S)-2-(2-bromophenyl)-2-(methylamino)ethanol
CID 93471242
[1-(2-bromophenyl)-2-(3,4-dimethylphenyl)ethyl]hydrazine
CID 105208668
1-(2,3-dihydrofuran-5-yl)-N-methyl-2-naphthalen-2-ylethanamine
CID 102652890
1-(4-bromothiophen-3-yl)-2-naphthalen-2-ylethanol
CID 105113172

Frequently Asked Questions

What is the IUPAC name of 1-(2-bromophenyl)-N-methyl-2-naphthalen-2-ylethanamine?
The IUPAC name of 1-(2-bromophenyl)-N-methyl-2-naphthalen-2-ylethanamine (CID 63529102) is 1-(2-bromophenyl)-N-methyl-2-naphthalen-2-ylethanamine.
What is the SMILES notation for 1-(2-bromophenyl)-N-methyl-2-naphthalen-2-ylethanamine?
The canonical SMILES for 1-(2-bromophenyl)-N-methyl-2-naphthalen-2-ylethanamine is CNC(Cc1ccc2ccccc2c1)c1ccccc1Br.
What is the InChIKey of 1-(2-bromophenyl)-N-methyl-2-naphthalen-2-ylethanamine?
The InChIKey is JWHYVUULOUIJPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18BrN/c1-21-19(17-8-4-5-9-18(17)20)13-14-10-11-15-6-2-3-7-16(15)12-14/h2-12,19,21H,13H2,1H3.
What are the key properties of 1-(2-bromophenyl)-N-methyl-2-naphthalen-2-ylethanamine?
1-(2-bromophenyl)-N-methyl-2-naphthalen-2-ylethanamine has a molecular weight of 340.26 g/mol, XLogP of 5.11, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-bromophenyl)-N-methyl-2-naphthalen-2-ylethanamine is sourced from PubChem (CID 63529102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).