1-(4-chlorophenyl)-2-methoxy-N-methyl-2-phenylethanamine

C16H18ClNO — CID 116772626

IUPAC1-(4-chlorophenyl)-2-methoxy-N-methyl-2-phenylethanamine
SMILESCNC(c1ccc(Cl)cc1)C(OC)c1ccccc1
InChIInChI=1S/C16H18ClNO/c1-18-15(12-8-10-14(17)11-9-12)16(19-2)13-6-4-3-5-7-13/h3-11,15-16,18H,1-2H3
InChIKeySRLJSLJQYYNIGE-UHFFFAOYSA-N
MW275.78 g/mol
LogP3.99
Rot. Bonds5

About 1-(4-chlorophenyl)-2-methoxy-N-methyl-2-phenylethanamine

1-(4-chlorophenyl)-2-methoxy-N-methyl-2-phenylethanamine (PubChem CID 116772626) has the molecular formula C16H18ClNO and a molecular weight of 275.78 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-2-methoxy-N-methyl-2-phenylethanamine.

Molecular Properties

Compound Name1-(4-chlorophenyl)-2-methoxy-N-methyl-2-phenylethanamine
PubChem CID116772626
Molecular FormulaC16H18ClNO
Molecular Weight275.78 g/mol
Exact Mass275.11
IUPAC Name1-(4-chlorophenyl)-2-methoxy-N-methyl-2-phenylethanamine
SMILESCNC(c1ccc(Cl)cc1)C(OC)c1ccccc1
InChIInChI=1S/C16H18ClNO/c1-18-15(12-8-10-14(17)11-9-12)16(19-2)13-6-4-3-5-7-13/h3-11,15-16,18H,1-2H3
InChIKeySRLJSLJQYYNIGE-UHFFFAOYSA-N
XLogP3.99
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.78
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(4-chlorophenyl)-2-methoxy-N-methyl-2-phenylethanamine 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-(3-chlorophenyl)-2-methoxy-N-methyl-2-phenylethanamine
CID 116772654
1-chloro-4-(1-methoxy-2-nitroso-2-phenylethyl)benzene
CID 57271893
1-(3-ethoxyphenyl)-2-methoxy-N-methyl-2-phenylethanamine
CID 116772649
1-(2,3-difluoro-4-methylphenyl)-2-methoxy-N-methyl-2-phenylethanamine
CID 107513901
[1-(4-chlorophenyl)-2-ethoxy-2-phenylethyl]hydrazine
CID 105279275
3-(4-chlorophenyl)-2-methoxy-N-methyl-3-phenylpropan-1-amine
CID 141113717
(1S,2R)-1,2-bis(4-chlorophenyl)-N'-methylethane-1,2-diamine
CID 67126047
1-(4-chlorophenyl)-1-methoxypropan-2-amine
CID 54594037
1-(3,4-difluorophenyl)-N-ethyl-2-methoxy-2-phenylethanamine
CID 116773143
3-(2-chlorophenyl)-1-methoxy-N-methyl-1-phenylpropan-2-amine
CID 116772583
(1R)-1-(4-chlorophenyl)-2-ethyl-N-methylbutan-1-amine
CID 93063130
N-[(1R)-1-(4-chlorophenyl)ethyl]-2-methyl-1-phenylpropan-1-amine
CID 81353330

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-2-methoxy-N-methyl-2-phenylethanamine?
The IUPAC name of 1-(4-chlorophenyl)-2-methoxy-N-methyl-2-phenylethanamine (CID 116772626) is 1-(4-chlorophenyl)-2-methoxy-N-methyl-2-phenylethanamine.
What is the SMILES notation for 1-(4-chlorophenyl)-2-methoxy-N-methyl-2-phenylethanamine?
The canonical SMILES for 1-(4-chlorophenyl)-2-methoxy-N-methyl-2-phenylethanamine is CNC(c1ccc(Cl)cc1)C(OC)c1ccccc1.
What is the InChIKey of 1-(4-chlorophenyl)-2-methoxy-N-methyl-2-phenylethanamine?
The InChIKey is SRLJSLJQYYNIGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18ClNO/c1-18-15(12-8-10-14(17)11-9-12)16(19-2)13-6-4-3-5-7-13/h3-11,15-16,18H,1-2H3.
What are the key properties of 1-(4-chlorophenyl)-2-methoxy-N-methyl-2-phenylethanamine?
1-(4-chlorophenyl)-2-methoxy-N-methyl-2-phenylethanamine has a molecular weight of 275.78 g/mol, XLogP of 3.99, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-2-methoxy-N-methyl-2-phenylethanamine is sourced from PubChem (CID 116772626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).