2-(3-methylphenyl)-2-(1-methylpyrrolidin-2-yl)ethanamine

C14H22N2 — CID 82393170

IUPAC2-(3-methylphenyl)-2-(1-methylpyrrolidin-2-yl)ethanamine
SMILESCc1cccc(C(CN)C2CCCN2C)c1
InChIInChI=1S/C14H22N2/c1-11-5-3-6-12(9-11)13(10-15)14-7-4-8-16(14)2/h3,5-6,9,13-14H,4,7-8,10,15H2,1-2H3
InChIKeyZEGWQKQEUVBXNV-UHFFFAOYSA-N
MW218.34 g/mol
LogP2.13
Rot. Bonds3

About 2-(3-methylphenyl)-2-(1-methylpyrrolidin-2-yl)ethanamine

2-(3-methylphenyl)-2-(1-methylpyrrolidin-2-yl)ethanamine (PubChem CID 82393170) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is 2-(3-methylphenyl)-2-(1-methylpyrrolidin-2-yl)ethanamine.

Molecular Properties

Compound Name2-(3-methylphenyl)-2-(1-methylpyrrolidin-2-yl)ethanamine
PubChem CID82393170
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name2-(3-methylphenyl)-2-(1-methylpyrrolidin-2-yl)ethanamine
SMILESCc1cccc(C(CN)C2CCCN2C)c1
InChIInChI=1S/C14H22N2/c1-11-5-3-6-12(9-11)13(10-15)14-7-4-8-16(14)2/h3,5-6,9,13-14H,4,7-8,10,15H2,1-2H3
InChIKeyZEGWQKQEUVBXNV-UHFFFAOYSA-N
XLogP2.13
TPSA29.26 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 ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(3-methylphenyl)-2-(1-methylpyrrolidin-2-yl)ethanamine 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

2-(4-tert-butylphenyl)-2-(1-methylpiperidin-2-yl)ethanamine
CID 83987713
(2S)-2-(3-methylphenyl)-2-(4-methylpiperidin-1-yl)ethanamine
CID 93489665
2-(3-ethylpiperidin-1-yl)-2-(3-methylphenyl)ethanamine
CID 43584386
2-[4-(cyclopropylmethyl)piperazin-1-yl]-2-(3-methylphenyl)ethanamine
CID 61440628
2-(3-ethyl-4-methylpiperazin-1-yl)-2-(3-methylphenyl)ethanamine
CID 63605560
2-benzhydryl-1-methylpyrrolidine
CID 71178925
2-(3-methylphenyl)-2-(3-propan-2-ylpyrrolidin-1-yl)ethanamine
CID 113416955
1-[2-amino-1-(3-methylphenyl)ethyl]-3-methylpiperidin-4-ol
CID 114677976
2-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)-2-(3-methylphenyl)ethanamine
CID 82747736
2-cyclopropyl-2-(3-methylphenyl)ethanol
CID 104819581
(3-methylphenyl)-(1-methylpiperazin-2-yl)methanamine
CID 116941309
1-[2-amino-1-(3-methylphenyl)ethyl]-N-methylpiperidine-3-carboxamide
CID 103194646

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylphenyl)-2-(1-methylpyrrolidin-2-yl)ethanamine?
The IUPAC name of 2-(3-methylphenyl)-2-(1-methylpyrrolidin-2-yl)ethanamine (CID 82393170) is 2-(3-methylphenyl)-2-(1-methylpyrrolidin-2-yl)ethanamine.
What is the SMILES notation for 2-(3-methylphenyl)-2-(1-methylpyrrolidin-2-yl)ethanamine?
The canonical SMILES for 2-(3-methylphenyl)-2-(1-methylpyrrolidin-2-yl)ethanamine is Cc1cccc(C(CN)C2CCCN2C)c1.
What is the InChIKey of 2-(3-methylphenyl)-2-(1-methylpyrrolidin-2-yl)ethanamine?
The InChIKey is ZEGWQKQEUVBXNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-11-5-3-6-12(9-11)13(10-15)14-7-4-8-16(14)2/h3,5-6,9,13-14H,4,7-8,10,15H2,1-2H3.
What are the key properties of 2-(3-methylphenyl)-2-(1-methylpyrrolidin-2-yl)ethanamine?
2-(3-methylphenyl)-2-(1-methylpyrrolidin-2-yl)ethanamine has a molecular weight of 218.34 g/mol, XLogP of 2.13, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylphenyl)-2-(1-methylpyrrolidin-2-yl)ethanamine is sourced from PubChem (CID 82393170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).