4-(2-aminopropoxy)-1,6-dimethylpyridin-2-one;hydrochloride

C10H17ClN2O2 — CID 86262450

IUPAC4-(2-aminopropoxy)-1,6-dimethylpyridin-2-one;hydrochloride
SMILESCc1cc(OCC(C)N)cc(=O)n1C.Cl
InChIInChI=1S/C10H16N2O2.ClH/c1-7(11)6-14-9-4-8(2)12(3)10(13)5-9;/h4-5,7H,6,11H2,1-3H3;1H
InChIKeyNLXYEYMSIKTGQW-UHFFFAOYSA-N
MW232.71 g/mol
LogP0.84
Rot. Bonds3

About 4-(2-aminopropoxy)-1,6-dimethylpyridin-2-one;hydrochloride

4-(2-aminopropoxy)-1,6-dimethylpyridin-2-one;hydrochloride (PubChem CID 86262450) has the molecular formula C10H17ClN2O2 and a molecular weight of 232.71 g/mol. Its IUPAC name is 4-(2-aminopropoxy)-1,6-dimethylpyridin-2-one;hydrochloride.

Molecular Properties

Compound Name4-(2-aminopropoxy)-1,6-dimethylpyridin-2-one;hydrochloride
PubChem CID86262450
Molecular FormulaC10H17ClN2O2
Molecular Weight232.71 g/mol
Exact Mass232.10
IUPAC Name4-(2-aminopropoxy)-1,6-dimethylpyridin-2-one;hydrochloride
SMILESCc1cc(OCC(C)N)cc(=O)n1C.Cl
InChIInChI=1S/C10H16N2O2.ClH/c1-7(11)6-14-9-4-8(2)12(3)10(13)5-9;/h4-5,7H,6,11H2,1-3H3;1H
InChIKeyNLXYEYMSIKTGQW-UHFFFAOYSA-N
XLogP0.84
TPSA57.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.71
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-(2-aminopropoxy)-1,6-dimethylpyridin-2-one;hydrochloride 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 4-(2-aminopropoxy)-1,6-dimethylpyridin-2-one;hydrochloride?
The IUPAC name of 4-(2-aminopropoxy)-1,6-dimethylpyridin-2-one;hydrochloride (CID 86262450) is 4-(2-aminopropoxy)-1,6-dimethylpyridin-2-one;hydrochloride.
What is the SMILES notation for 4-(2-aminopropoxy)-1,6-dimethylpyridin-2-one;hydrochloride?
The canonical SMILES for 4-(2-aminopropoxy)-1,6-dimethylpyridin-2-one;hydrochloride is Cc1cc(OCC(C)N)cc(=O)n1C.Cl.
What is the InChIKey of 4-(2-aminopropoxy)-1,6-dimethylpyridin-2-one;hydrochloride?
The InChIKey is NLXYEYMSIKTGQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2.ClH/c1-7(11)6-14-9-4-8(2)12(3)10(13)5-9;/h4-5,7H,6,11H2,1-3H3;1H.
What are the key properties of 4-(2-aminopropoxy)-1,6-dimethylpyridin-2-one;hydrochloride?
4-(2-aminopropoxy)-1,6-dimethylpyridin-2-one;hydrochloride has a molecular weight of 232.71 g/mol, XLogP of 0.84, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-aminopropoxy)-1,6-dimethylpyridin-2-one;hydrochloride is sourced from PubChem (CID 86262450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).