[5-(3,5-dimethoxy-2-methylphenyl)-1-methylpyrrolidin-3-yl]methanamine

C15H24N2O2 — CID 117415847

IUPAC[5-(3,5-dimethoxy-2-methylphenyl)-1-methylpyrrolidin-3-yl]methanamine
SMILESCOc1cc(OC)c(C)c(C2CC(CN)CN2C)c1
InChIInChI=1S/C15H24N2O2/c1-10-13(6-12(18-3)7-15(10)19-4)14-5-11(8-16)9-17(14)2/h6-7,11,14H,5,8-9,16H2,1-4H3
InChIKeyYNWDVXCMGLMJHO-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.96
Rot. Bonds4

About [5-(3,5-dimethoxy-2-methylphenyl)-1-methylpyrrolidin-3-yl]methanamine

[5-(3,5-dimethoxy-2-methylphenyl)-1-methylpyrrolidin-3-yl]methanamine (PubChem CID 117415847) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is [5-(3,5-dimethoxy-2-methylphenyl)-1-methylpyrrolidin-3-yl]methanamine.

Molecular Properties

Compound Name[5-(3,5-dimethoxy-2-methylphenyl)-1-methylpyrrolidin-3-yl]methanamine
PubChem CID117415847
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name[5-(3,5-dimethoxy-2-methylphenyl)-1-methylpyrrolidin-3-yl]methanamine
SMILESCOc1cc(OC)c(C)c(C2CC(CN)CN2C)c1
InChIInChI=1S/C15H24N2O2/c1-10-13(6-12(18-3)7-15(10)19-4)14-5-11(8-16)9-17(14)2/h6-7,11,14H,5,8-9,16H2,1-4H3
InChIKeyYNWDVXCMGLMJHO-UHFFFAOYSA-N
XLogP1.96
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [5-(3,5-dimethoxy-2-methylphenyl)-1-methylpyrrolidin-3-yl]methanamine 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

[5-(2-fluoro-4,6-dimethoxyphenyl)-1-methylpyrrolidin-3-yl]methanamine
CID 117424729
[5-(3-methoxy-2-methylphenyl)-1-methylpyrrolidin-3-yl]methanamine
CID 117341079
2-[4-(aminomethyl)-1-methylpyrrolidin-2-yl]-6-chloro-4-methoxyphenol
CID 117430067
[5-(2,5-dichloro-4-methoxyphenyl)-1-methylpyrrolidin-3-yl]methanamine
CID 117467090
[1-methyl-5-(2,3,4-trimethoxyphenyl)pyrrolidin-3-yl]methanamine
CID 117450281
[5-(5-chloro-2,3-dimethoxy-4-methylphenyl)-1-methylpyrrolidin-3-yl]methanamine
CID 117481351
2-[4-(aminomethyl)-1-methylpyrrolidin-2-yl]-4-fluoro-5-methoxyphenol
CID 117389235
[5-(5-ethoxy-2,4-dimethoxyphenyl)-1-methylpyrrolidin-3-yl]methanamine
CID 117475063
[5-[4-(fluoromethyl)-2,5-dimethoxyphenyl]-1-methylpyrrolidin-3-yl]methanamine
CID 117453931
[5-(2,3-difluoro-4-methoxyphenyl)-1-methylpyrrolidin-3-yl]methanamine
CID 117394097
[5-(5-methoxy-2-methyl-1H-indol-6-yl)-1-methylpyrrolidin-3-yl]methanamine
CID 117436417
4-[4-(aminomethyl)-1-methylpyrrolidin-2-yl]-2,3,6-trimethylphenol
CID 117117153

Frequently Asked Questions

What is the IUPAC name of [5-(3,5-dimethoxy-2-methylphenyl)-1-methylpyrrolidin-3-yl]methanamine?
The IUPAC name of [5-(3,5-dimethoxy-2-methylphenyl)-1-methylpyrrolidin-3-yl]methanamine (CID 117415847) is [5-(3,5-dimethoxy-2-methylphenyl)-1-methylpyrrolidin-3-yl]methanamine.
What is the SMILES notation for [5-(3,5-dimethoxy-2-methylphenyl)-1-methylpyrrolidin-3-yl]methanamine?
The canonical SMILES for [5-(3,5-dimethoxy-2-methylphenyl)-1-methylpyrrolidin-3-yl]methanamine is COc1cc(OC)c(C)c(C2CC(CN)CN2C)c1.
What is the InChIKey of [5-(3,5-dimethoxy-2-methylphenyl)-1-methylpyrrolidin-3-yl]methanamine?
The InChIKey is YNWDVXCMGLMJHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-10-13(6-12(18-3)7-15(10)19-4)14-5-11(8-16)9-17(14)2/h6-7,11,14H,5,8-9,16H2,1-4H3.
What are the key properties of [5-(3,5-dimethoxy-2-methylphenyl)-1-methylpyrrolidin-3-yl]methanamine?
[5-(3,5-dimethoxy-2-methylphenyl)-1-methylpyrrolidin-3-yl]methanamine has a molecular weight of 264.37 g/mol, XLogP of 1.96, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(3,5-dimethoxy-2-methylphenyl)-1-methylpyrrolidin-3-yl]methanamine is sourced from PubChem (CID 117415847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).