1-(4-methoxyphenyl)-N-[(3-methoxyphenyl)methyl]-N-methylmethanamine

C17H21NO2 — CID 22070460

IUPAC1-(4-methoxyphenyl)-N-[(3-methoxyphenyl)methyl]-N-methylmethanamine
SMILESCOc1ccc(CN(C)Cc2cccc(OC)c2)cc1
InChIInChI=1S/C17H21NO2/c1-18(12-14-7-9-16(19-2)10-8-14)13-15-5-4-6-17(11-15)20-3/h4-11H,12-13H2,1-3H3
InChIKeyDHLGTAJNSVRBIB-UHFFFAOYSA-N
MW271.36 g/mol
LogP3.34
Rot. Bonds6

About 1-(4-methoxyphenyl)-N-[(3-methoxyphenyl)methyl]-N-methylmethanamine

1-(4-methoxyphenyl)-N-[(3-methoxyphenyl)methyl]-N-methylmethanamine (PubChem CID 22070460) has the molecular formula C17H21NO2 and a molecular weight of 271.36 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-N-[(3-methoxyphenyl)methyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-N-[(3-methoxyphenyl)methyl]-N-methylmethanamine
PubChem CID22070460
Molecular FormulaC17H21NO2
Molecular Weight271.36 g/mol
Exact Mass271.16
IUPAC Name1-(4-methoxyphenyl)-N-[(3-methoxyphenyl)methyl]-N-methylmethanamine
SMILESCOc1ccc(CN(C)Cc2cccc(OC)c2)cc1
InChIInChI=1S/C17H21NO2/c1-18(12-14-7-9-16(19-2)10-8-14)13-15-5-4-6-17(11-15)20-3/h4-11H,12-13H2,1-3H3
InChIKeyDHLGTAJNSVRBIB-UHFFFAOYSA-N
XLogP3.34
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[(3-methoxyphenyl)methyl-methylamino]methyl]-2-methylaniline
CID 61418042
N-[(2-deuterio-3,4-dimethoxyphenyl)methyl]-1-(3-methoxyphenyl)-N-methylmethanamine
CID 101056991
N-[(2,5-difluorophenyl)methyl]-1-(3-methoxyphenyl)-N-methylmethanamine
CID 171329064
N-[[3-(azidomethyl)phenyl]methyl]-1-(4-methoxyphenyl)-N-methylmethanamine
CID 53231679
N-[(2,6-dimethylphenyl)methyl]-1-(4-methoxyphenyl)-N-methylmethanamine
CID 143173593
4-[(3-methoxyphenyl)methyl-methylamino]butan-2-one
CID 60648128
3-chloro-N-[(3-methoxyphenyl)methyl]-N-methylpropan-1-amine
CID 61417614
N'-[(3-fluorophenyl)methyl]-N,N'-dimethylmethanediamine;N'-[(4-methoxyphenyl)methyl]-N,N'-dimethylmethanediamine
CID 177179048
5-[[(3-methoxyphenyl)methyl-methylamino]methyl]-N-methylpyridin-2-amine
CID 62208653
1-(3-methoxyphenyl)-N-methyl-N-[(2-methyl-1,3-oxazol-4-yl)methyl]methanamine
CID 171328466
N-[(4-methoxyphenyl)methyl]-N-methyl-1-(4-phenylphenyl)methanamine
CID 134791729
N-(4-methoxyphenyl)-2-[(3-methoxyphenyl)methyl-methylamino]acetamide
CID 2656678

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-N-[(3-methoxyphenyl)methyl]-N-methylmethanamine?
The IUPAC name of 1-(4-methoxyphenyl)-N-[(3-methoxyphenyl)methyl]-N-methylmethanamine (CID 22070460) is 1-(4-methoxyphenyl)-N-[(3-methoxyphenyl)methyl]-N-methylmethanamine.
What is the SMILES notation for 1-(4-methoxyphenyl)-N-[(3-methoxyphenyl)methyl]-N-methylmethanamine?
The canonical SMILES for 1-(4-methoxyphenyl)-N-[(3-methoxyphenyl)methyl]-N-methylmethanamine is COc1ccc(CN(C)Cc2cccc(OC)c2)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-N-[(3-methoxyphenyl)methyl]-N-methylmethanamine?
The InChIKey is DHLGTAJNSVRBIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO2/c1-18(12-14-7-9-16(19-2)10-8-14)13-15-5-4-6-17(11-15)20-3/h4-11H,12-13H2,1-3H3.
What are the key properties of 1-(4-methoxyphenyl)-N-[(3-methoxyphenyl)methyl]-N-methylmethanamine?
1-(4-methoxyphenyl)-N-[(3-methoxyphenyl)methyl]-N-methylmethanamine has a molecular weight of 271.36 g/mol, XLogP of 3.34, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-N-[(3-methoxyphenyl)methyl]-N-methylmethanamine is sourced from PubChem (CID 22070460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).