1-(2,4-dimethylphenyl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine

C19H25NO — CID 43482663

IUPAC1-(2,4-dimethylphenyl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine
SMILESCNC(CCc1ccc(OC)cc1)c1ccc(C)cc1C
InChIInChI=1S/C19H25NO/c1-14-5-11-18(15(2)13-14)19(20-3)12-8-16-6-9-17(21-4)10-7-16/h5-7,9-11,13,19-20H,8,12H2,1-4H3
InChIKeyKQPZICPAJBYVMC-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.21
Rot. Bonds6

About 1-(2,4-dimethylphenyl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine

1-(2,4-dimethylphenyl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine (PubChem CID 43482663) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 1-(2,4-dimethylphenyl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine.

Molecular Properties

Compound Name1-(2,4-dimethylphenyl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine
PubChem CID43482663
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name1-(2,4-dimethylphenyl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine
SMILESCNC(CCc1ccc(OC)cc1)c1ccc(C)cc1C
InChIInChI=1S/C19H25NO/c1-14-5-11-18(15(2)13-14)19(20-3)12-8-16-6-9-17(21-4)10-7-16/h5-7,9-11,13,19-20H,8,12H2,1-4H3
InChIKeyKQPZICPAJBYVMC-UHFFFAOYSA-N
XLogP4.21
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3,5-dimethylphenyl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine
CID 115796419
3-(4-methoxyphenyl)-N-methyl-1-(3-methylphenyl)propan-1-amine
CID 65444758
1-(4-methoxy-2-methylphenyl)-N-methyl-2-(4-methylphenyl)ethanamine
CID 43482745
1-(2,5-dimethylphenyl)-N-methyl-3-(4-methylphenyl)propan-1-amine
CID 105120019
[1-(4-bromo-2-methylphenyl)-3-(4-methoxyphenyl)propyl]hydrazine
CID 105310534
1-(2-iodophenyl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine
CID 115864663
1-(2-chlorophenyl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine
CID 65446090
N-methyl-1-(2-methylphenyl)-3-(4-methylphenyl)propan-1-amine
CID 105094431
1-(2-chloro-5-fluorophenyl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine
CID 105397498
1-(2,4-dimethoxyphenyl)-N-methyl-3-phenylpropan-1-amine
CID 43483666
[1-(2-fluoro-5-methylphenyl)-3-(4-methoxyphenyl)propyl]hydrazine
CID 105302706
methyl 4-(2,4-dimethylphenyl)-4-(methylamino)butanoate
CID 116955511

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dimethylphenyl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine?
The IUPAC name of 1-(2,4-dimethylphenyl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine (CID 43482663) is 1-(2,4-dimethylphenyl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine.
What is the SMILES notation for 1-(2,4-dimethylphenyl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine?
The canonical SMILES for 1-(2,4-dimethylphenyl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine is CNC(CCc1ccc(OC)cc1)c1ccc(C)cc1C.
What is the InChIKey of 1-(2,4-dimethylphenyl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine?
The InChIKey is KQPZICPAJBYVMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-14-5-11-18(15(2)13-14)19(20-3)12-8-16-6-9-17(21-4)10-7-16/h5-7,9-11,13,19-20H,8,12H2,1-4H3.
What are the key properties of 1-(2,4-dimethylphenyl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine?
1-(2,4-dimethylphenyl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine has a molecular weight of 283.42 g/mol, XLogP of 4.21, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dimethylphenyl)-3-(4-methoxyphenyl)-N-methylpropan-1-amine is sourced from PubChem (CID 43482663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).