4-methyl-1-(2-pyridin-2-ylethyl)pyrrolidin-3-amine

C12H19N3 — CID 103576660

IUPAC4-methyl-1-(2-pyridin-2-ylethyl)pyrrolidin-3-amine
SMILESCC1CN(CCc2ccccn2)CC1N
InChIInChI=1S/C12H19N3/c1-10-8-15(9-12(10)13)7-5-11-4-2-3-6-14-11/h2-4,6,10,12H,5,7-9,13H2,1H3
InChIKeyHYMRMWPYXPFDGV-UHFFFAOYSA-N
MW205.31 g/mol
LogP0.90
Rot. Bonds3

About 4-methyl-1-(2-pyridin-2-ylethyl)pyrrolidin-3-amine

4-methyl-1-(2-pyridin-2-ylethyl)pyrrolidin-3-amine (PubChem CID 103576660) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is 4-methyl-1-(2-pyridin-2-ylethyl)pyrrolidin-3-amine.

Molecular Properties

Compound Name4-methyl-1-(2-pyridin-2-ylethyl)pyrrolidin-3-amine
PubChem CID103576660
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC Name4-methyl-1-(2-pyridin-2-ylethyl)pyrrolidin-3-amine
SMILESCC1CN(CCc2ccccn2)CC1N
InChIInChI=1S/C12H19N3/c1-10-8-15(9-12(10)13)7-5-11-4-2-3-6-14-11/h2-4,6,10,12H,5,7-9,13H2,1H3
InChIKeyHYMRMWPYXPFDGV-UHFFFAOYSA-N
XLogP0.90
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(2-pyridin-2-ylethyl)pyrrolidin-3-amine?
The IUPAC name of 4-methyl-1-(2-pyridin-2-ylethyl)pyrrolidin-3-amine (CID 103576660) is 4-methyl-1-(2-pyridin-2-ylethyl)pyrrolidin-3-amine.
What is the SMILES notation for 4-methyl-1-(2-pyridin-2-ylethyl)pyrrolidin-3-amine?
The canonical SMILES for 4-methyl-1-(2-pyridin-2-ylethyl)pyrrolidin-3-amine is CC1CN(CCc2ccccn2)CC1N.
What is the InChIKey of 4-methyl-1-(2-pyridin-2-ylethyl)pyrrolidin-3-amine?
The InChIKey is HYMRMWPYXPFDGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-10-8-15(9-12(10)13)7-5-11-4-2-3-6-14-11/h2-4,6,10,12H,5,7-9,13H2,1H3.
What are the key properties of 4-methyl-1-(2-pyridin-2-ylethyl)pyrrolidin-3-amine?
4-methyl-1-(2-pyridin-2-ylethyl)pyrrolidin-3-amine has a molecular weight of 205.31 g/mol, XLogP of 0.90, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(2-pyridin-2-ylethyl)pyrrolidin-3-amine is sourced from PubChem (CID 103576660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).