4-pyrrolidin-1-ylpyridin-3-amine

C9H13N3 — CID 18953539

IUPAC4-pyrrolidin-1-ylpyridin-3-amine
SMILESNc1cnccc1N1CCCC1
InChIInChI=1S/C9H13N3/c10-8-7-11-4-3-9(8)12-5-1-2-6-12/h3-4,7H,1-2,5-6,10H2
InChIKeyIXNZFEAFVPIIQR-UHFFFAOYSA-N
MW163.22 g/mol
LogP1.26
Rot. Bonds1

About 4-pyrrolidin-1-ylpyridin-3-amine

4-pyrrolidin-1-ylpyridin-3-amine (PubChem CID 18953539) has the molecular formula C9H13N3 and a molecular weight of 163.22 g/mol. Its IUPAC name is 4-pyrrolidin-1-ylpyridin-3-amine.

Molecular Properties

Compound Name4-pyrrolidin-1-ylpyridin-3-amine
PubChem CID18953539
Molecular FormulaC9H13N3
Molecular Weight163.22 g/mol
Exact Mass163.11
IUPAC Name4-pyrrolidin-1-ylpyridin-3-amine
SMILESNc1cnccc1N1CCCC1
InChIInChI=1S/C9H13N3/c10-8-7-11-4-3-9(8)12-5-1-2-6-12/h3-4,7H,1-2,5-6,10H2
InChIKeyIXNZFEAFVPIIQR-UHFFFAOYSA-N
XLogP1.26
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-pyrrolidin-1-ylpyridin-3-amine?
The IUPAC name of 4-pyrrolidin-1-ylpyridin-3-amine (CID 18953539) is 4-pyrrolidin-1-ylpyridin-3-amine.
What is the SMILES notation for 4-pyrrolidin-1-ylpyridin-3-amine?
The canonical SMILES for 4-pyrrolidin-1-ylpyridin-3-amine is Nc1cnccc1N1CCCC1.
What is the InChIKey of 4-pyrrolidin-1-ylpyridin-3-amine?
The InChIKey is IXNZFEAFVPIIQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3/c10-8-7-11-4-3-9(8)12-5-1-2-6-12/h3-4,7H,1-2,5-6,10H2.
What are the key properties of 4-pyrrolidin-1-ylpyridin-3-amine?
4-pyrrolidin-1-ylpyridin-3-amine has a molecular weight of 163.22 g/mol, XLogP of 1.26, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pyrrolidin-1-ylpyridin-3-amine is sourced from PubChem (CID 18953539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).