1-(2,3-dichlorophenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine

C16H17Cl2N — CID 43483845

IUPAC1-(2,3-dichlorophenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine
SMILESCNC(c1cc(C)ccc1C)c1cccc(Cl)c1Cl
InChIInChI=1S/C16H17Cl2N/c1-10-7-8-11(2)13(9-10)16(19-3)12-5-4-6-14(17)15(12)18/h4-9,16,19H,1-3H3
InChIKeyXQNOSRDLQRQOOO-UHFFFAOYSA-N
MW294.23 g/mol
LogP4.92
Rot. Bonds3

About 1-(2,3-dichlorophenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine

1-(2,3-dichlorophenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine (PubChem CID 43483845) has the molecular formula C16H17Cl2N and a molecular weight of 294.23 g/mol. Its IUPAC name is 1-(2,3-dichlorophenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(2,3-dichlorophenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine
PubChem CID43483845
Molecular FormulaC16H17Cl2N
Molecular Weight294.23 g/mol
Exact Mass293.07
IUPAC Name1-(2,3-dichlorophenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine
SMILESCNC(c1cc(C)ccc1C)c1cccc(Cl)c1Cl
InChIInChI=1S/C16H17Cl2N/c1-10-7-8-11(2)13(9-10)16(19-3)12-5-4-6-14(17)15(12)18/h4-9,16,19H,1-3H3
InChIKeyXQNOSRDLQRQOOO-UHFFFAOYSA-N
XLogP4.92
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.23
LogP ≤ 54.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2,5-dichlorophenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine
CID 43483853
1-(2,3-dichlorophenyl)-1-(2,4-difluoro-5-methylphenyl)-N-methylmethanamine
CID 79724980
1-(7-chloro-1-benzofuran-2-yl)-1-(2,5-dimethylphenyl)-N-methylmethanamine
CID 105048549
1-(2,5-dimethylphenyl)-1-(2-iodophenyl)-N-methylmethanamine
CID 43483778
1-(2-chloro-3-fluorophenyl)-1-(2-fluoro-5-methylphenyl)-N-methylmethanamine
CID 115852601
[(2,3-dichlorophenyl)-(5-fluoro-2-methylphenyl)methyl]hydrazine
CID 105211607
1-(2-bromophenyl)-1-(2,3-dichlorophenyl)-N-methylmethanamine
CID 63417166
N-[(2,3-dichlorophenyl)-(2,4-dimethylphenyl)methyl]ethanamine
CID 43490022
1-(2-chloro-5-fluorophenyl)-1-(2-chloro-3-methylphenyl)-N-methylmethanamine
CID 105397270
1-(2,5-dimethylphenyl)-N-methyl-1-(2-propoxyphenyl)methanamine
CID 105035882
1-(2,5-dimethylphenyl)-1-(3-iodophenyl)-N-methylmethanamine
CID 43483766
2-(2-chloro-4-methylphenyl)-1-(2,3-dichlorophenyl)-N-methylethanamine
CID 106867306

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dichlorophenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine?
The IUPAC name of 1-(2,3-dichlorophenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine (CID 43483845) is 1-(2,3-dichlorophenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine.
What is the SMILES notation for 1-(2,3-dichlorophenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine?
The canonical SMILES for 1-(2,3-dichlorophenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine is CNC(c1cc(C)ccc1C)c1cccc(Cl)c1Cl.
What is the InChIKey of 1-(2,3-dichlorophenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine?
The InChIKey is XQNOSRDLQRQOOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17Cl2N/c1-10-7-8-11(2)13(9-10)16(19-3)12-5-4-6-14(17)15(12)18/h4-9,16,19H,1-3H3.
What are the key properties of 1-(2,3-dichlorophenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine?
1-(2,3-dichlorophenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine has a molecular weight of 294.23 g/mol, XLogP of 4.92, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dichlorophenyl)-1-(2,5-dimethylphenyl)-N-methylmethanamine is sourced from PubChem (CID 43483845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).