[2-(2,4-dimethylphenyl)-4-methoxyphenyl]methanamine

C16H19NO — CID 141455779

IUPAC[2-(2,4-dimethylphenyl)-4-methoxyphenyl]methanamine
SMILESCOc1ccc(CN)c(-c2ccc(C)cc2C)c1
InChIInChI=1S/C16H19NO/c1-11-4-7-15(12(2)8-11)16-9-14(18-3)6-5-13(16)10-17/h4-9H,10,17H2,1-3H3
InChIKeyJOCNMZGYCNIOQU-UHFFFAOYSA-N
MW241.33 g/mol
LogP3.44
Rot. Bonds3

About [2-(2,4-dimethylphenyl)-4-methoxyphenyl]methanamine

[2-(2,4-dimethylphenyl)-4-methoxyphenyl]methanamine (PubChem CID 141455779) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is [2-(2,4-dimethylphenyl)-4-methoxyphenyl]methanamine.

Molecular Properties

Compound Name[2-(2,4-dimethylphenyl)-4-methoxyphenyl]methanamine
PubChem CID141455779
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Name[2-(2,4-dimethylphenyl)-4-methoxyphenyl]methanamine
SMILESCOc1ccc(CN)c(-c2ccc(C)cc2C)c1
InChIInChI=1S/C16H19NO/c1-11-4-7-15(12(2)8-11)16-9-14(18-3)6-5-13(16)10-17/h4-9H,10,17H2,1-3H3
InChIKeyJOCNMZGYCNIOQU-UHFFFAOYSA-N
XLogP3.44
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-(2-methoxy-3,4-dimethylphenyl)-4-methylphenyl]methanamine
CID 103434113
2-[2-(2,5-dimethoxyphenyl)-4-methylphenyl]ethanamine
CID 137354597
[4-(2,4-dimethoxyphenyl)-3-methylphenyl]methanamine
CID 66479632
[4-methoxy-2-[(2,4,6-trimethylphenyl)methoxy]phenyl]methanamine
CID 62543773
(2,4-dimethylphenyl)methanamine;propane
CID 143780972
[2-[(2,5-dimethylphenyl)methoxy]-5-methoxyphenyl]methanamine
CID 61481790
[2-(3,4-dichlorophenyl)-4-methoxyphenyl]methanamine
CID 112749101
CID 155696635
CID 155696635
(2-chloro-4-methoxyphenyl)methanamine
CID 22467642
ethane;1-[(4-methoxyphenyl)methyl]-2,4-dimethylbenzene
CID 143200250
2-(4-methoxy-2-methylphenyl)-5-methylbenzaldehyde
CID 172649146
2-(aminomethyl)-5-methoxyphenol;ethane
CID 154662698

Frequently Asked Questions

What is the IUPAC name of [2-(2,4-dimethylphenyl)-4-methoxyphenyl]methanamine?
The IUPAC name of [2-(2,4-dimethylphenyl)-4-methoxyphenyl]methanamine (CID 141455779) is [2-(2,4-dimethylphenyl)-4-methoxyphenyl]methanamine.
What is the SMILES notation for [2-(2,4-dimethylphenyl)-4-methoxyphenyl]methanamine?
The canonical SMILES for [2-(2,4-dimethylphenyl)-4-methoxyphenyl]methanamine is COc1ccc(CN)c(-c2ccc(C)cc2C)c1.
What is the InChIKey of [2-(2,4-dimethylphenyl)-4-methoxyphenyl]methanamine?
The InChIKey is JOCNMZGYCNIOQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-11-4-7-15(12(2)8-11)16-9-14(18-3)6-5-13(16)10-17/h4-9H,10,17H2,1-3H3.
What are the key properties of [2-(2,4-dimethylphenyl)-4-methoxyphenyl]methanamine?
[2-(2,4-dimethylphenyl)-4-methoxyphenyl]methanamine has a molecular weight of 241.33 g/mol, XLogP of 3.44, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,4-dimethylphenyl)-4-methoxyphenyl]methanamine is sourced from PubChem (CID 141455779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).