5-amino-1-(2-methoxyethyl)pyridin-2-one;hydrochloride

C8H13ClN2O2 — CID 42887712

IUPAC5-amino-1-(2-methoxyethyl)pyridin-2-one;hydrochloride
SMILESCOCCn1cc(N)ccc1=O.Cl
InChIInChI=1S/C8H12N2O2.ClH/c1-12-5-4-10-6-7(9)2-3-8(10)11;/h2-3,6H,4-5,9H2,1H3;1H
InChIKeyLXTLXOUBZNKOLR-UHFFFAOYSA-N
MW204.66 g/mol
LogP0.50
Rot. Bonds3

About 5-amino-1-(2-methoxyethyl)pyridin-2-one;hydrochloride

5-amino-1-(2-methoxyethyl)pyridin-2-one;hydrochloride (PubChem CID 42887712) has the molecular formula C8H13ClN2O2 and a molecular weight of 204.66 g/mol. Its IUPAC name is 5-amino-1-(2-methoxyethyl)pyridin-2-one;hydrochloride.

Molecular Properties

Compound Name5-amino-1-(2-methoxyethyl)pyridin-2-one;hydrochloride
PubChem CID42887712
Molecular FormulaC8H13ClN2O2
Molecular Weight204.66 g/mol
Exact Mass204.07
IUPAC Name5-amino-1-(2-methoxyethyl)pyridin-2-one;hydrochloride
SMILESCOCCn1cc(N)ccc1=O.Cl
InChIInChI=1S/C8H12N2O2.ClH/c1-12-5-4-10-6-7(9)2-3-8(10)11;/h2-3,6H,4-5,9H2,1H3;1H
InChIKeyLXTLXOUBZNKOLR-UHFFFAOYSA-N
XLogP0.50
TPSA57.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.66
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-amino-1-(2-methoxyethyl)pyridin-2-one;hydrochloride?
The IUPAC name of 5-amino-1-(2-methoxyethyl)pyridin-2-one;hydrochloride (CID 42887712) is 5-amino-1-(2-methoxyethyl)pyridin-2-one;hydrochloride.
What is the SMILES notation for 5-amino-1-(2-methoxyethyl)pyridin-2-one;hydrochloride?
The canonical SMILES for 5-amino-1-(2-methoxyethyl)pyridin-2-one;hydrochloride is COCCn1cc(N)ccc1=O.Cl.
What is the InChIKey of 5-amino-1-(2-methoxyethyl)pyridin-2-one;hydrochloride?
The InChIKey is LXTLXOUBZNKOLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O2.ClH/c1-12-5-4-10-6-7(9)2-3-8(10)11;/h2-3,6H,4-5,9H2,1H3;1H.
What are the key properties of 5-amino-1-(2-methoxyethyl)pyridin-2-one;hydrochloride?
5-amino-1-(2-methoxyethyl)pyridin-2-one;hydrochloride has a molecular weight of 204.66 g/mol, XLogP of 0.50, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-(2-methoxyethyl)pyridin-2-one;hydrochloride is sourced from PubChem (CID 42887712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).