1-(2-methoxyphenyl)-N-methyl-4-(3-methylphenyl)butan-2-amine

C19H25NO — CID 62367274

IUPAC1-(2-methoxyphenyl)-N-methyl-4-(3-methylphenyl)butan-2-amine
SMILESCNC(CCc1cccc(C)c1)Cc1ccccc1OC
InChIInChI=1S/C19H25NO/c1-15-7-6-8-16(13-15)11-12-18(20-2)14-17-9-4-5-10-19(17)21-3/h4-10,13,18,20H,11-12,14H2,1-3H3
InChIKeyWNSWEPWBJJOUTA-UHFFFAOYSA-N
MW283.42 g/mol
LogP3.77
Rot. Bonds7

About 1-(2-methoxyphenyl)-N-methyl-4-(3-methylphenyl)butan-2-amine

1-(2-methoxyphenyl)-N-methyl-4-(3-methylphenyl)butan-2-amine (PubChem CID 62367274) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-N-methyl-4-(3-methylphenyl)butan-2-amine.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-N-methyl-4-(3-methylphenyl)butan-2-amine
PubChem CID62367274
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name1-(2-methoxyphenyl)-N-methyl-4-(3-methylphenyl)butan-2-amine
SMILESCNC(CCc1cccc(C)c1)Cc1ccccc1OC
InChIInChI=1S/C19H25NO/c1-15-7-6-8-16(13-15)11-12-18(20-2)14-17-9-4-5-10-19(17)21-3/h4-10,13,18,20H,11-12,14H2,1-3H3
InChIKeyWNSWEPWBJJOUTA-UHFFFAOYSA-N
XLogP3.77
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-chlorophenyl)-N-methyl-4-(3-methylphenyl)butan-2-amine
CID 63527888
2-[(2-methoxyphenyl)methyl]-N-methyl-3-(3-methylphenyl)propan-1-amine
CID 62515411
1-(4-ethylphenyl)-N-methyl-4-(3-methylphenyl)butan-2-amine
CID 105101719
1-(2-methoxyphenyl)-N-methyl-3-(4-methylphenyl)propan-2-amine
CID 61262537
1-(2-chloro-4-fluorophenyl)-N-methyl-4-(3-methylphenyl)butan-2-amine
CID 105133367
1-(2,4-dichlorophenyl)-N-methyl-4-(3-methylphenyl)butan-2-amine
CID 105132746
1-(2-methoxyphenyl)-N,5,5-trimethylhexan-2-amine
CID 62601026
6-methoxy-N,6-dimethyl-1-(3-methylphenyl)heptan-3-amine
CID 103032202
1-(2-methoxy-5-methylphenyl)-N-methyl-3-(3-methylphenyl)propan-1-amine
CID 105144092
1-(2-methoxyphenyl)-N-methyl-3-methylsulfanylpropan-2-amine
CID 62692992
1-(2-methoxyphenyl)-N,4-dimethylpentan-2-amine
CID 61066103
N,5-dimethyl-1-(3-methylphenyl)heptan-3-amine
CID 105138418

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-N-methyl-4-(3-methylphenyl)butan-2-amine?
The IUPAC name of 1-(2-methoxyphenyl)-N-methyl-4-(3-methylphenyl)butan-2-amine (CID 62367274) is 1-(2-methoxyphenyl)-N-methyl-4-(3-methylphenyl)butan-2-amine.
What is the SMILES notation for 1-(2-methoxyphenyl)-N-methyl-4-(3-methylphenyl)butan-2-amine?
The canonical SMILES for 1-(2-methoxyphenyl)-N-methyl-4-(3-methylphenyl)butan-2-amine is CNC(CCc1cccc(C)c1)Cc1ccccc1OC.
What is the InChIKey of 1-(2-methoxyphenyl)-N-methyl-4-(3-methylphenyl)butan-2-amine?
The InChIKey is WNSWEPWBJJOUTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-15-7-6-8-16(13-15)11-12-18(20-2)14-17-9-4-5-10-19(17)21-3/h4-10,13,18,20H,11-12,14H2,1-3H3.
What are the key properties of 1-(2-methoxyphenyl)-N-methyl-4-(3-methylphenyl)butan-2-amine?
1-(2-methoxyphenyl)-N-methyl-4-(3-methylphenyl)butan-2-amine has a molecular weight of 283.42 g/mol, XLogP of 3.77, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-N-methyl-4-(3-methylphenyl)butan-2-amine is sourced from PubChem (CID 62367274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).