N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine

C8H18N2 — CID 54112396

IUPACN-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine
SMILESCCN(C)CC1CCNC1
InChIInChI=1S/C8H18N2/c1-3-10(2)7-8-4-5-9-6-8/h8-9H,3-7H2,1-2H3
InChIKeyQWVOIUJSOWUXNE-UHFFFAOYSA-N
MW142.25 g/mol
LogP0.55
Rot. Bonds3

About N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine

N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine (PubChem CID 54112396) has the molecular formula C8H18N2 and a molecular weight of 142.25 g/mol. Its IUPAC name is N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine.

Molecular Properties

Compound NameN-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine
PubChem CID54112396
Molecular FormulaC8H18N2
Molecular Weight142.25 g/mol
Exact Mass142.15
IUPAC NameN-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine
SMILESCCN(C)CC1CCNC1
InChIInChI=1S/C8H18N2/c1-3-10(2)7-8-4-5-9-6-8/h8-9H,3-7H2,1-2H3
InChIKeyQWVOIUJSOWUXNE-UHFFFAOYSA-N
XLogP0.55
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.25
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-methyl-N-(pyrrolidin-3-ylmethyl)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-N-(pyrrolidin-3-ylmethyl)ethanamine?
The IUPAC name of N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine (CID 54112396) is N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine.
What is the SMILES notation for N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine?
The canonical SMILES for N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine is CCN(C)CC1CCNC1.
What is the InChIKey of N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine?
The InChIKey is QWVOIUJSOWUXNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2/c1-3-10(2)7-8-4-5-9-6-8/h8-9H,3-7H2,1-2H3.
What are the key properties of N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine?
N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine has a molecular weight of 142.25 g/mol, XLogP of 0.55, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine is sourced from PubChem (CID 54112396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).