N-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine

C14H22N2 — CID 60974257

IUPACN-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine
SMILESCNC(C)c1ccccc1N1CCCC1C
InChIInChI=1S/C14H22N2/c1-11-7-6-10-16(11)14-9-5-4-8-13(14)12(2)15-3/h4-5,8-9,11-12,15H,6-7,10H2,1-3H3
InChIKeySYFKSDIBXUSGIO-UHFFFAOYSA-N
MW218.34 g/mol
LogP2.96
Rot. Bonds3

About N-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine

N-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine (PubChem CID 60974257) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is N-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine.

Molecular Properties

Compound NameN-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine
PubChem CID60974257
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC NameN-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine
SMILESCNC(C)c1ccccc1N1CCCC1C
InChIInChI=1S/C14H22N2/c1-11-7-6-10-16(11)14-9-5-4-8-13(14)12(2)15-3/h4-5,8-9,11-12,15H,6-7,10H2,1-3H3
InChIKeySYFKSDIBXUSGIO-UHFFFAOYSA-N
XLogP2.96
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine?
The IUPAC name of N-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine (CID 60974257) is N-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine.
What is the SMILES notation for N-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine?
The canonical SMILES for N-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine is CNC(C)c1ccccc1N1CCCC1C.
What is the InChIKey of N-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine?
The InChIKey is SYFKSDIBXUSGIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-11-7-6-10-16(11)14-9-5-4-8-13(14)12(2)15-3/h4-5,8-9,11-12,15H,6-7,10H2,1-3H3.
What are the key properties of N-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine?
N-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine has a molecular weight of 218.34 g/mol, XLogP of 2.96, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-(2-methylpyrrolidin-1-yl)phenyl]ethanamine is sourced from PubChem (CID 60974257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).