1-(5-bromothiophen-2-yl)-1-(2,5-dimethylphenyl)-N-methylmethanamine

C14H16BrNS — CID 43483741

IUPAC1-(5-bromothiophen-2-yl)-1-(2,5-dimethylphenyl)-N-methylmethanamine
SMILESCNC(c1ccc(Br)s1)c1cc(C)ccc1C
InChIInChI=1S/C14H16BrNS/c1-9-4-5-10(2)11(8-9)14(16-3)12-6-7-13(15)17-12/h4-8,14,16H,1-3H3
InChIKeyCLCUHMJYWBIJMM-UHFFFAOYSA-N
MW310.26 g/mol
LogP4.44
Rot. Bonds3

About 1-(5-bromothiophen-2-yl)-1-(2,5-dimethylphenyl)-N-methylmethanamine

1-(5-bromothiophen-2-yl)-1-(2,5-dimethylphenyl)-N-methylmethanamine (PubChem CID 43483741) has the molecular formula C14H16BrNS and a molecular weight of 310.26 g/mol. Its IUPAC name is 1-(5-bromothiophen-2-yl)-1-(2,5-dimethylphenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(5-bromothiophen-2-yl)-1-(2,5-dimethylphenyl)-N-methylmethanamine
PubChem CID43483741
Molecular FormulaC14H16BrNS
Molecular Weight310.26 g/mol
Exact Mass309.02
IUPAC Name1-(5-bromothiophen-2-yl)-1-(2,5-dimethylphenyl)-N-methylmethanamine
SMILESCNC(c1ccc(Br)s1)c1cc(C)ccc1C
InChIInChI=1S/C14H16BrNS/c1-9-4-5-10(2)11(8-9)14(16-3)12-6-7-13(15)17-12/h4-8,14,16H,1-3H3
InChIKeyCLCUHMJYWBIJMM-UHFFFAOYSA-N
XLogP4.44
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.26
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(5-bromothiophen-2-yl)-1-(2,5-dimethylphenyl)-N-methylmethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(5-bromothiophen-2-yl)-1-(2,3-difluoro-4-methylphenyl)-N-methylmethanamine
CID 107513386
1-(5-bromothiophen-2-yl)-1-(2,3-dimethylphenyl)-N-methylmethanamine
CID 61103986
1-(2,5-dimethylphenyl)-N-methyl-1-(thiadiazol-5-yl)methanamine
CID 105120600
1-(5-bromothiophen-2-yl)-N-methyl-1-(5-methylthiophen-2-yl)methanamine
CID 43480371
N-[(5-bromothiophen-2-yl)-(2,4-dimethylphenyl)methyl]propan-1-amine
CID 43495485
1-(2,5-dimethylphenyl)-N-methyl-1-thieno[3,2-b]thiophen-5-ylmethanamine
CID 80734021
1-(2-bromo-5-methylphenyl)-1-(5-chloro-4-methylthiophen-2-yl)-N-methylmethanamine
CID 102763637
1-(5-bromo-2-methoxyphenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine
CID 43480052
N-[(2,5-dibromothiophen-3-yl)-(2,5-dimethylphenyl)methyl]ethanamine
CID 43493204
1-(4-bromo-5-methylthiophen-2-yl)-1-(2-methoxy-5-methylphenyl)-N-methylmethanamine
CID 102827361
1-(3-bromo-4-methoxyphenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine
CID 43479934
1-(2,5-dimethylphenyl)-N-methyl-1-(1-methylpyrazol-3-yl)methanamine
CID 65200164

Frequently Asked Questions

What is the IUPAC name of 1-(5-bromothiophen-2-yl)-1-(2,5-dimethylphenyl)-N-methylmethanamine?
The IUPAC name of 1-(5-bromothiophen-2-yl)-1-(2,5-dimethylphenyl)-N-methylmethanamine (CID 43483741) is 1-(5-bromothiophen-2-yl)-1-(2,5-dimethylphenyl)-N-methylmethanamine.
What is the SMILES notation for 1-(5-bromothiophen-2-yl)-1-(2,5-dimethylphenyl)-N-methylmethanamine?
The canonical SMILES for 1-(5-bromothiophen-2-yl)-1-(2,5-dimethylphenyl)-N-methylmethanamine is CNC(c1ccc(Br)s1)c1cc(C)ccc1C.
What is the InChIKey of 1-(5-bromothiophen-2-yl)-1-(2,5-dimethylphenyl)-N-methylmethanamine?
The InChIKey is CLCUHMJYWBIJMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16BrNS/c1-9-4-5-10(2)11(8-9)14(16-3)12-6-7-13(15)17-12/h4-8,14,16H,1-3H3.
What are the key properties of 1-(5-bromothiophen-2-yl)-1-(2,5-dimethylphenyl)-N-methylmethanamine?
1-(5-bromothiophen-2-yl)-1-(2,5-dimethylphenyl)-N-methylmethanamine has a molecular weight of 310.26 g/mol, XLogP of 4.44, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromothiophen-2-yl)-1-(2,5-dimethylphenyl)-N-methylmethanamine is sourced from PubChem (CID 43483741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).