1-(3,4-dimethylphenyl)-3-(2-methoxy-5-methylphenyl)propan-2-amine

C19H25NO — CID 62899800

IUPAC1-(3,4-dimethylphenyl)-3-(2-methoxy-5-methylphenyl)propan-2-amine
SMILESCOc1ccc(C)cc1CC(N)Cc1ccc(C)c(C)c1
InChIInChI=1S/C19H25NO/c1-13-5-8-19(21-4)17(9-13)12-18(20)11-16-7-6-14(2)15(3)10-16/h5-10,18H,11-12,20H2,1-4H3
InChIKeyOSPATCOSKPOKPN-UHFFFAOYSA-N
MW283.42 g/mol
LogP3.73
Rot. Bonds5

About 1-(3,4-dimethylphenyl)-3-(2-methoxy-5-methylphenyl)propan-2-amine

1-(3,4-dimethylphenyl)-3-(2-methoxy-5-methylphenyl)propan-2-amine (PubChem CID 62899800) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 1-(3,4-dimethylphenyl)-3-(2-methoxy-5-methylphenyl)propan-2-amine.

Molecular Properties

Compound Name1-(3,4-dimethylphenyl)-3-(2-methoxy-5-methylphenyl)propan-2-amine
PubChem CID62899800
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name1-(3,4-dimethylphenyl)-3-(2-methoxy-5-methylphenyl)propan-2-amine
SMILESCOc1ccc(C)cc1CC(N)Cc1ccc(C)c(C)c1
InChIInChI=1S/C19H25NO/c1-13-5-8-19(21-4)17(9-13)12-18(20)11-16-7-6-14(2)15(3)10-16/h5-10,18H,11-12,20H2,1-4H3
InChIKeyOSPATCOSKPOKPN-UHFFFAOYSA-N
XLogP3.73
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-bromo-4-methoxyphenyl)-3-(3,4-dimethylphenyl)propan-2-amine
CID 62899973
1-(2-methoxy-5-methylphenyl)butan-2-amine;hydrochloride
CID 170889680
1-(2-methoxy-5-methylphenyl)-5-methylhexan-2-amine
CID 55041467
1-(2-methoxy-5-methylphenyl)undecan-2-amine
CID 115826519
5-[(2-methoxy-5-methylphenyl)methyl]-2-methylaniline
CID 82044512
methyl 3-amino-4-(2-methoxy-5-methylphenyl)butanoate
CID 82351379
1-(5-bromo-2-methylphenyl)-2-(2-methoxy-5-methylphenyl)ethanamine
CID 115826789
1-(3,4-dimethylphenyl)-3-(5-fluoro-2-methylphenyl)propan-2-amine
CID 105373859
1-(3,4-difluorophenyl)-3-(2,5-dimethylphenyl)propan-2-amine
CID 115802634
1-butan-2-ylsulfanyl-3-(2-methoxy-5-methylphenyl)propan-2-amine
CID 65136479
1-(2-methoxy-5-methylphenyl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-2-amine
CID 105118289
1,1-diethoxy-3-(2-methoxy-5-methylphenyl)propan-2-amine
CID 79495090

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dimethylphenyl)-3-(2-methoxy-5-methylphenyl)propan-2-amine?
The IUPAC name of 1-(3,4-dimethylphenyl)-3-(2-methoxy-5-methylphenyl)propan-2-amine (CID 62899800) is 1-(3,4-dimethylphenyl)-3-(2-methoxy-5-methylphenyl)propan-2-amine.
What is the SMILES notation for 1-(3,4-dimethylphenyl)-3-(2-methoxy-5-methylphenyl)propan-2-amine?
The canonical SMILES for 1-(3,4-dimethylphenyl)-3-(2-methoxy-5-methylphenyl)propan-2-amine is COc1ccc(C)cc1CC(N)Cc1ccc(C)c(C)c1.
What is the InChIKey of 1-(3,4-dimethylphenyl)-3-(2-methoxy-5-methylphenyl)propan-2-amine?
The InChIKey is OSPATCOSKPOKPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-13-5-8-19(21-4)17(9-13)12-18(20)11-16-7-6-14(2)15(3)10-16/h5-10,18H,11-12,20H2,1-4H3.
What are the key properties of 1-(3,4-dimethylphenyl)-3-(2-methoxy-5-methylphenyl)propan-2-amine?
1-(3,4-dimethylphenyl)-3-(2-methoxy-5-methylphenyl)propan-2-amine has a molecular weight of 283.42 g/mol, XLogP of 3.73, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dimethylphenyl)-3-(2-methoxy-5-methylphenyl)propan-2-amine is sourced from PubChem (CID 62899800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).