1-(2-methyl-3-pyridinyl)-N-propan-2-ylpyrrolidin-3-amine

C13H21N3 — CID 79043514

IUPAC1-(2-methyl-3-pyridinyl)-N-propan-2-ylpyrrolidin-3-amine
SMILESCc1ncccc1N1CCC(NC(C)C)C1
InChIInChI=1S/C13H21N3/c1-10(2)15-12-6-8-16(9-12)13-5-4-7-14-11(13)3/h4-5,7,10,12,15H,6,8-9H2,1-3H3
InChIKeyNRVXCQJMZMABIO-UHFFFAOYSA-N
MW219.33 g/mol
LogP1.97
Rot. Bonds3

About 1-(2-methyl-3-pyridinyl)-N-propan-2-ylpyrrolidin-3-amine

1-(2-methyl-3-pyridinyl)-N-propan-2-ylpyrrolidin-3-amine (PubChem CID 79043514) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is 1-(2-methyl-3-pyridinyl)-N-propan-2-ylpyrrolidin-3-amine.

Molecular Properties

Compound Name1-(2-methyl-3-pyridinyl)-N-propan-2-ylpyrrolidin-3-amine
PubChem CID79043514
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name1-(2-methyl-3-pyridinyl)-N-propan-2-ylpyrrolidin-3-amine
SMILESCc1ncccc1N1CCC(NC(C)C)C1
InChIInChI=1S/C13H21N3/c1-10(2)15-12-6-8-16(9-12)13-5-4-7-14-11(13)3/h4-5,7,10,12,15H,6,8-9H2,1-3H3
InChIKeyNRVXCQJMZMABIO-UHFFFAOYSA-N
XLogP1.97
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(2-methyl-3-pyridinyl)-N-propan-2-ylpyrrolidin-3-amine 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 1-(2-methyl-3-pyridinyl)-N-propan-2-ylpyrrolidin-3-amine?
The IUPAC name of 1-(2-methyl-3-pyridinyl)-N-propan-2-ylpyrrolidin-3-amine (CID 79043514) is 1-(2-methyl-3-pyridinyl)-N-propan-2-ylpyrrolidin-3-amine.
What is the SMILES notation for 1-(2-methyl-3-pyridinyl)-N-propan-2-ylpyrrolidin-3-amine?
The canonical SMILES for 1-(2-methyl-3-pyridinyl)-N-propan-2-ylpyrrolidin-3-amine is Cc1ncccc1N1CCC(NC(C)C)C1.
What is the InChIKey of 1-(2-methyl-3-pyridinyl)-N-propan-2-ylpyrrolidin-3-amine?
The InChIKey is NRVXCQJMZMABIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-10(2)15-12-6-8-16(9-12)13-5-4-7-14-11(13)3/h4-5,7,10,12,15H,6,8-9H2,1-3H3.
What are the key properties of 1-(2-methyl-3-pyridinyl)-N-propan-2-ylpyrrolidin-3-amine?
1-(2-methyl-3-pyridinyl)-N-propan-2-ylpyrrolidin-3-amine has a molecular weight of 219.33 g/mol, XLogP of 1.97, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyl-3-pyridinyl)-N-propan-2-ylpyrrolidin-3-amine is sourced from PubChem (CID 79043514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).