2-pyrrolidin-3-ylquinolin-3-amine

C13H15N3 — CID 144553438

IUPAC2-pyrrolidin-3-ylquinolin-3-amine
SMILESNc1cc2ccccc2nc1C1CCNC1
InChIInChI=1S/C13H15N3/c14-11-7-9-3-1-2-4-12(9)16-13(11)10-5-6-15-8-10/h1-4,7,10,15H,5-6,8,14H2
InChIKeyCLCTVGSNEKZSMP-UHFFFAOYSA-N
MW213.28 g/mol
LogP1.89
Rot. Bonds1

About 2-pyrrolidin-3-ylquinolin-3-amine

2-pyrrolidin-3-ylquinolin-3-amine (PubChem CID 144553438) has the molecular formula C13H15N3 and a molecular weight of 213.28 g/mol. Its IUPAC name is 2-pyrrolidin-3-ylquinolin-3-amine.

Molecular Properties

Compound Name2-pyrrolidin-3-ylquinolin-3-amine
PubChem CID144553438
Molecular FormulaC13H15N3
Molecular Weight213.28 g/mol
Exact Mass213.13
IUPAC Name2-pyrrolidin-3-ylquinolin-3-amine
SMILESNc1cc2ccccc2nc1C1CCNC1
InChIInChI=1S/C13H15N3/c14-11-7-9-3-1-2-4-12(9)16-13(11)10-5-6-15-8-10/h1-4,7,10,15H,5-6,8,14H2
InChIKeyCLCTVGSNEKZSMP-UHFFFAOYSA-N
XLogP1.89
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-pyrrolidin-3-ylquinolin-3-amine?
The IUPAC name of 2-pyrrolidin-3-ylquinolin-3-amine (CID 144553438) is 2-pyrrolidin-3-ylquinolin-3-amine.
What is the SMILES notation for 2-pyrrolidin-3-ylquinolin-3-amine?
The canonical SMILES for 2-pyrrolidin-3-ylquinolin-3-amine is Nc1cc2ccccc2nc1C1CCNC1.
What is the InChIKey of 2-pyrrolidin-3-ylquinolin-3-amine?
The InChIKey is CLCTVGSNEKZSMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3/c14-11-7-9-3-1-2-4-12(9)16-13(11)10-5-6-15-8-10/h1-4,7,10,15H,5-6,8,14H2.
What are the key properties of 2-pyrrolidin-3-ylquinolin-3-amine?
2-pyrrolidin-3-ylquinolin-3-amine has a molecular weight of 213.28 g/mol, XLogP of 1.89, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrrolidin-3-ylquinolin-3-amine is sourced from PubChem (CID 144553438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).