6-[2-(propylamino)ethoxy]pyridin-3-amine

C10H17N3O — CID 69235236

IUPAC6-[2-(propylamino)ethoxy]pyridin-3-amine
SMILESCCCNCCOc1ccc(N)cn1
InChIInChI=1S/C10H17N3O/c1-2-5-12-6-7-14-10-4-3-9(11)8-13-10/h3-4,8,12H,2,5-7,11H2,1H3
InChIKeyYXRFNUYQNZEDGW-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.04
Rot. Bonds6

About 6-[2-(propylamino)ethoxy]pyridin-3-amine

6-[2-(propylamino)ethoxy]pyridin-3-amine (PubChem CID 69235236) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 6-[2-(propylamino)ethoxy]pyridin-3-amine.

Molecular Properties

Compound Name6-[2-(propylamino)ethoxy]pyridin-3-amine
PubChem CID69235236
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name6-[2-(propylamino)ethoxy]pyridin-3-amine
SMILESCCCNCCOc1ccc(N)cn1
InChIInChI=1S/C10H17N3O/c1-2-5-12-6-7-14-10-4-3-9(11)8-13-10/h3-4,8,12H,2,5-7,11H2,1H3
InChIKeyYXRFNUYQNZEDGW-UHFFFAOYSA-N
XLogP1.04
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-[2-(propylamino)ethoxy]pyridin-3-amine?
The IUPAC name of 6-[2-(propylamino)ethoxy]pyridin-3-amine (CID 69235236) is 6-[2-(propylamino)ethoxy]pyridin-3-amine.
What is the SMILES notation for 6-[2-(propylamino)ethoxy]pyridin-3-amine?
The canonical SMILES for 6-[2-(propylamino)ethoxy]pyridin-3-amine is CCCNCCOc1ccc(N)cn1.
What is the InChIKey of 6-[2-(propylamino)ethoxy]pyridin-3-amine?
The InChIKey is YXRFNUYQNZEDGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-2-5-12-6-7-14-10-4-3-9(11)8-13-10/h3-4,8,12H,2,5-7,11H2,1H3.
What are the key properties of 6-[2-(propylamino)ethoxy]pyridin-3-amine?
6-[2-(propylamino)ethoxy]pyridin-3-amine has a molecular weight of 195.27 g/mol, XLogP of 1.04, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(propylamino)ethoxy]pyridin-3-amine is sourced from PubChem (CID 69235236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).