1-(2,4-dimethoxyphenyl)-N-[(2-methylphenyl)methyl]methanamine

C17H21NO2 — CID 39370180

IUPAC1-(2,4-dimethoxyphenyl)-N-[(2-methylphenyl)methyl]methanamine
SMILESCOc1ccc(CNCc2ccccc2C)c(OC)c1
InChIInChI=1S/C17H21NO2/c1-13-6-4-5-7-14(13)11-18-12-15-8-9-16(19-2)10-17(15)20-3/h4-10,18H,11-12H2,1-3H3
InChIKeyJZJNPPLAZSWLOQ-UHFFFAOYSA-N
MW271.36 g/mol
LogP3.30
Rot. Bonds6

About 1-(2,4-dimethoxyphenyl)-N-[(2-methylphenyl)methyl]methanamine

1-(2,4-dimethoxyphenyl)-N-[(2-methylphenyl)methyl]methanamine (PubChem CID 39370180) has the molecular formula C17H21NO2 and a molecular weight of 271.36 g/mol. Its IUPAC name is 1-(2,4-dimethoxyphenyl)-N-[(2-methylphenyl)methyl]methanamine.

Molecular Properties

Compound Name1-(2,4-dimethoxyphenyl)-N-[(2-methylphenyl)methyl]methanamine
PubChem CID39370180
Molecular FormulaC17H21NO2
Molecular Weight271.36 g/mol
Exact Mass271.16
IUPAC Name1-(2,4-dimethoxyphenyl)-N-[(2-methylphenyl)methyl]methanamine
SMILESCOc1ccc(CNCc2ccccc2C)c(OC)c1
InChIInChI=1S/C17H21NO2/c1-13-6-4-5-7-14(13)11-18-12-15-8-9-16(19-2)10-17(15)20-3/h4-10,18H,11-12H2,1-3H3
InChIKeyJZJNPPLAZSWLOQ-UHFFFAOYSA-N
XLogP3.30
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,4-dimethoxyphenyl)-N-[(2,6-dimethylphenyl)methyl]methanamine
CID 81318862
2-[[(2,4-dimethoxyphenyl)methylamino]methyl]phenol
CID 62732592
5-methoxy-2-[[(2-methylphenyl)methylamino]methyl]phenol
CID 61262143
N-[(2-chlorophenyl)methyl]-1-(2,4-dimethoxyphenyl)methanamine
CID 4719073
1-(2,4-dimethoxyphenyl)-N-[(5-fluoro-2-methylphenyl)methyl]methanamine
CID 115967968
N-[(2-chlorophenyl)methyl]-1-(2,4-dimethoxyphenyl)methanamine;hydrochloride
CID 17293463
N-[(2,4-dimethoxyphenyl)methyl]-1-(3-methoxy-4-methylphenyl)methanamine
CID 122598505
N-[(2,4-dimethoxyphenyl)methyl]-1-(3-methoxyphenyl)methanamine
CID 738572
N-[(2,6-dichlorophenyl)methyl]-1-(2,4-dimethoxyphenyl)methanamine
CID 60961220
1-(2,4-dimethoxyphenyl)-N-[(3,5-dimethoxyphenyl)methyl]methanamine;hydrochloride
CID 47020695
2-[(2,4-dimethoxyphenyl)methylamino]ethanethiol
CID 115223928
N-[(2,4-dimethoxyphenyl)methyl]-2-phenylethanamine;hydrochloride
CID 17293467

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dimethoxyphenyl)-N-[(2-methylphenyl)methyl]methanamine?
The IUPAC name of 1-(2,4-dimethoxyphenyl)-N-[(2-methylphenyl)methyl]methanamine (CID 39370180) is 1-(2,4-dimethoxyphenyl)-N-[(2-methylphenyl)methyl]methanamine.
What is the SMILES notation for 1-(2,4-dimethoxyphenyl)-N-[(2-methylphenyl)methyl]methanamine?
The canonical SMILES for 1-(2,4-dimethoxyphenyl)-N-[(2-methylphenyl)methyl]methanamine is COc1ccc(CNCc2ccccc2C)c(OC)c1.
What is the InChIKey of 1-(2,4-dimethoxyphenyl)-N-[(2-methylphenyl)methyl]methanamine?
The InChIKey is JZJNPPLAZSWLOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO2/c1-13-6-4-5-7-14(13)11-18-12-15-8-9-16(19-2)10-17(15)20-3/h4-10,18H,11-12H2,1-3H3.
What are the key properties of 1-(2,4-dimethoxyphenyl)-N-[(2-methylphenyl)methyl]methanamine?
1-(2,4-dimethoxyphenyl)-N-[(2-methylphenyl)methyl]methanamine has a molecular weight of 271.36 g/mol, XLogP of 3.30, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dimethoxyphenyl)-N-[(2-methylphenyl)methyl]methanamine is sourced from PubChem (CID 39370180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).