6-propoxypyridin-2-amine

C8H12N2O — CID 4080796

IUPAC6-propoxypyridin-2-amine
SMILESCCCOc1cccc(N)n1
InChIInChI=1S/C8H12N2O/c1-2-6-11-8-5-3-4-7(9)10-8/h3-5H,2,6H2,1H3,(H2,9,10)
InChIKeyZYCJWHDLJBDOPP-UHFFFAOYSA-N
MW152.20 g/mol
LogP1.45
Rot. Bonds3

About 6-propoxypyridin-2-amine

6-propoxypyridin-2-amine (PubChem CID 4080796) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is 6-propoxypyridin-2-amine.

Molecular Properties

Compound Name6-propoxypyridin-2-amine
PubChem CID4080796
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC Name6-propoxypyridin-2-amine
SMILESCCCOc1cccc(N)n1
InChIInChI=1S/C8H12N2O/c1-2-6-11-8-5-3-4-7(9)10-8/h3-5H,2,6H2,1H3,(H2,9,10)
InChIKeyZYCJWHDLJBDOPP-UHFFFAOYSA-N
XLogP1.45
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-propoxypyridin-2-amine?
The IUPAC name of 6-propoxypyridin-2-amine (CID 4080796) is 6-propoxypyridin-2-amine.
What is the SMILES notation for 6-propoxypyridin-2-amine?
The canonical SMILES for 6-propoxypyridin-2-amine is CCCOc1cccc(N)n1.
What is the InChIKey of 6-propoxypyridin-2-amine?
The InChIKey is ZYCJWHDLJBDOPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O/c1-2-6-11-8-5-3-4-7(9)10-8/h3-5H,2,6H2,1H3,(H2,9,10).
What are the key properties of 6-propoxypyridin-2-amine?
6-propoxypyridin-2-amine has a molecular weight of 152.20 g/mol, XLogP of 1.45, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-propoxypyridin-2-amine is sourced from PubChem (CID 4080796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).