2-benzyl-3-(3-methoxyphenyl)-N,N-dimethylpropan-1-amine

C19H25NO — CID 141033426

IUPAC2-benzyl-3-(3-methoxyphenyl)-N,N-dimethylpropan-1-amine
SMILESCOc1cccc(CC(Cc2ccccc2)CN(C)C)c1
InChIInChI=1S/C19H25NO/c1-20(2)15-18(12-16-8-5-4-6-9-16)13-17-10-7-11-19(14-17)21-3/h4-11,14,18H,12-13,15H2,1-3H3
InChIKeyCRCYYZXKGPYWGB-UHFFFAOYSA-N
MW283.42 g/mol
LogP3.66
Rot. Bonds7

About 2-benzyl-3-(3-methoxyphenyl)-N,N-dimethylpropan-1-amine

2-benzyl-3-(3-methoxyphenyl)-N,N-dimethylpropan-1-amine (PubChem CID 141033426) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 2-benzyl-3-(3-methoxyphenyl)-N,N-dimethylpropan-1-amine.

Molecular Properties

Compound Name2-benzyl-3-(3-methoxyphenyl)-N,N-dimethylpropan-1-amine
PubChem CID141033426
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name2-benzyl-3-(3-methoxyphenyl)-N,N-dimethylpropan-1-amine
SMILESCOc1cccc(CC(Cc2ccccc2)CN(C)C)c1
InChIInChI=1S/C19H25NO/c1-20(2)15-18(12-16-8-5-4-6-9-16)13-17-10-7-11-19(14-17)21-3/h4-11,14,18H,12-13,15H2,1-3H3
InChIKeyCRCYYZXKGPYWGB-UHFFFAOYSA-N
XLogP3.66
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-benzyl-3-(3-methoxyphenyl)-N,N-dimethylpropan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-methoxy-3-(2-methoxypropyl)benzene
CID 56987806
(E,2S)-2-benzyl-3-(3-methoxyphenyl)-N,N-dimethylpent-3-en-1-amine;hydrochloride
CID 70008456
2-benzyl-N',N'-dimethylpropane-1,3-diamine
CID 23008665
1-[2-(chloromethyl)-3-(3-methoxyphenyl)propyl]-4-methylbenzene
CID 66033705
2-[(3-methoxyphenyl)methyl]-3-(4-methylphenyl)propan-1-amine
CID 62503999
1-N-(3-methoxyphenyl)-1-N-methyl-3-phenylpropane-1,2-diamine
CID 62004171
(2S,3S)-3-benzyl-4-(dimethylamino)-1,1,1-trifluoro-2-(3-methoxyphenyl)butan-2-ol
CID 70010842
1-[2-(chloromethyl)-3-methoxypropyl]-3-methoxybenzene
CID 103985127
1-[(2S)-2-bromopropyl]-3-methoxybenzene
CID 129368805
(2S)-2-amino-3-(3-methoxyphenyl)propan-1-ol
CID 28804581
N-[(3-methoxyphenyl)methyl]-N-methylaniline
CID 66916764
1-(3-methoxyphenyl)-4-phenylbutan-2-ol
CID 55136240

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-3-(3-methoxyphenyl)-N,N-dimethylpropan-1-amine?
The IUPAC name of 2-benzyl-3-(3-methoxyphenyl)-N,N-dimethylpropan-1-amine (CID 141033426) is 2-benzyl-3-(3-methoxyphenyl)-N,N-dimethylpropan-1-amine.
What is the SMILES notation for 2-benzyl-3-(3-methoxyphenyl)-N,N-dimethylpropan-1-amine?
The canonical SMILES for 2-benzyl-3-(3-methoxyphenyl)-N,N-dimethylpropan-1-amine is COc1cccc(CC(Cc2ccccc2)CN(C)C)c1.
What is the InChIKey of 2-benzyl-3-(3-methoxyphenyl)-N,N-dimethylpropan-1-amine?
The InChIKey is CRCYYZXKGPYWGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-20(2)15-18(12-16-8-5-4-6-9-16)13-17-10-7-11-19(14-17)21-3/h4-11,14,18H,12-13,15H2,1-3H3.
What are the key properties of 2-benzyl-3-(3-methoxyphenyl)-N,N-dimethylpropan-1-amine?
2-benzyl-3-(3-methoxyphenyl)-N,N-dimethylpropan-1-amine has a molecular weight of 283.42 g/mol, XLogP of 3.66, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-3-(3-methoxyphenyl)-N,N-dimethylpropan-1-amine is sourced from PubChem (CID 141033426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).