N-methyl-1-[3-methyl-1-(2-phenylethyl)pyrrolidin-3-yl]methanamine

C15H24N2 — CID 106318668

IUPACN-methyl-1-[3-methyl-1-(2-phenylethyl)pyrrolidin-3-yl]methanamine
SMILESCNCC1(C)CCN(CCc2ccccc2)C1
InChIInChI=1S/C15H24N2/c1-15(12-16-2)9-11-17(13-15)10-8-14-6-4-3-5-7-14/h3-7,16H,8-13H2,1-2H3
InChIKeyOAIVHSPHWXJGPY-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.16
Rot. Bonds5

About N-methyl-1-[3-methyl-1-(2-phenylethyl)pyrrolidin-3-yl]methanamine

N-methyl-1-[3-methyl-1-(2-phenylethyl)pyrrolidin-3-yl]methanamine (PubChem CID 106318668) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is N-methyl-1-[3-methyl-1-(2-phenylethyl)pyrrolidin-3-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[3-methyl-1-(2-phenylethyl)pyrrolidin-3-yl]methanamine
PubChem CID106318668
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC NameN-methyl-1-[3-methyl-1-(2-phenylethyl)pyrrolidin-3-yl]methanamine
SMILESCNCC1(C)CCN(CCc2ccccc2)C1
InChIInChI=1S/C15H24N2/c1-15(12-16-2)9-11-17(13-15)10-8-14-6-4-3-5-7-14/h3-7,16H,8-13H2,1-2H3
InChIKeyOAIVHSPHWXJGPY-UHFFFAOYSA-N
XLogP2.16
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-[3-methyl-1-(2-thiophen-3-ylethyl)pyrrolidin-3-yl]methanamine
CID 106318742
N-methyl-1-[3-methyl-1-(3-phenoxypropyl)pyrrolidin-3-yl]methanamine
CID 106318811
5-(2-phenylethyl)-5-azaspiro[2.4]heptane
CID 142337171
1-[1-[(3-chlorophenyl)methyl]-3-methylpyrrolidin-3-yl]-N-methylmethanamine
CID 114172884
ethane;2-[4-methyl-1-(2-phenylethyl)piperidin-4-yl]acetonitrile
CID 145395121
N-methyl-1-[3-methyl-1-(3-methylbutyl)pyrrolidin-3-yl]methanamine
CID 106318615
1-[1-[(2,6-dichlorophenyl)methyl]-3-methylpyrrolidin-3-yl]-N-methylmethanamine
CID 106318678
[3-methyl-1-[2-(4-methylphenyl)ethyl]pyrrolidin-3-yl]methanamine
CID 120773709
1-[1-[(3,5-dimethylphenyl)methyl]-3-methylpyrrolidin-3-yl]-N-methylmethanamine
CID 106318622
1-benzyl-3-(methylaminomethyl)pyrrolidin-3-ol;dihydrochloride
CID 19382170
(4R)-1-ethyl-7-(2-phenylethyl)-1,7-diazaspiro[3.4]octane
CID 97397493
N-methyl-1-[3-methyl-1-(thiophen-2-ylmethyl)pyrrolidin-3-yl]methanamine
CID 106318625

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[3-methyl-1-(2-phenylethyl)pyrrolidin-3-yl]methanamine?
The IUPAC name of N-methyl-1-[3-methyl-1-(2-phenylethyl)pyrrolidin-3-yl]methanamine (CID 106318668) is N-methyl-1-[3-methyl-1-(2-phenylethyl)pyrrolidin-3-yl]methanamine.
What is the SMILES notation for N-methyl-1-[3-methyl-1-(2-phenylethyl)pyrrolidin-3-yl]methanamine?
The canonical SMILES for N-methyl-1-[3-methyl-1-(2-phenylethyl)pyrrolidin-3-yl]methanamine is CNCC1(C)CCN(CCc2ccccc2)C1.
What is the InChIKey of N-methyl-1-[3-methyl-1-(2-phenylethyl)pyrrolidin-3-yl]methanamine?
The InChIKey is OAIVHSPHWXJGPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-15(12-16-2)9-11-17(13-15)10-8-14-6-4-3-5-7-14/h3-7,16H,8-13H2,1-2H3.
What are the key properties of N-methyl-1-[3-methyl-1-(2-phenylethyl)pyrrolidin-3-yl]methanamine?
N-methyl-1-[3-methyl-1-(2-phenylethyl)pyrrolidin-3-yl]methanamine has a molecular weight of 232.37 g/mol, XLogP of 2.16, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[3-methyl-1-(2-phenylethyl)pyrrolidin-3-yl]methanamine is sourced from PubChem (CID 106318668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).