6-amino-3,4-dihydro-2H-pyridin-5-one;hydrochloride

C5H9ClN2O — CID 18428532

IUPAC6-amino-3,4-dihydro-2H-pyridin-5-one;hydrochloride
SMILESCl.NC1=NCCCC1=O
InChIInChI=1S/C5H8N2O.ClH/c6-5-4(8)2-1-3-7-5;/h1-3H2,(H2,6,7);1H
InChIKeyJBAJCYVBUIBSFB-UHFFFAOYSA-N
MW148.59 g/mol
LogP0.13
Rot. Bonds

About 6-amino-3,4-dihydro-2H-pyridin-5-one;hydrochloride

6-amino-3,4-dihydro-2H-pyridin-5-one;hydrochloride (PubChem CID 18428532) has the molecular formula C5H9ClN2O and a molecular weight of 148.59 g/mol. Its IUPAC name is 6-amino-3,4-dihydro-2H-pyridin-5-one;hydrochloride.

Molecular Properties

Compound Name6-amino-3,4-dihydro-2H-pyridin-5-one;hydrochloride
PubChem CID18428532
Molecular FormulaC5H9ClN2O
Molecular Weight148.59 g/mol
Exact Mass148.04
IUPAC Name6-amino-3,4-dihydro-2H-pyridin-5-one;hydrochloride
SMILESCl.NC1=NCCCC1=O
InChIInChI=1S/C5H8N2O.ClH/c6-5-4(8)2-1-3-7-5;/h1-3H2,(H2,6,7);1H
InChIKeyJBAJCYVBUIBSFB-UHFFFAOYSA-N
XLogP0.13
TPSA55.45 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.59
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-amino-3,4-dihydro-2H-pyridin-5-one;hydrochloride?
The IUPAC name of 6-amino-3,4-dihydro-2H-pyridin-5-one;hydrochloride (CID 18428532) is 6-amino-3,4-dihydro-2H-pyridin-5-one;hydrochloride.
What is the SMILES notation for 6-amino-3,4-dihydro-2H-pyridin-5-one;hydrochloride?
The canonical SMILES for 6-amino-3,4-dihydro-2H-pyridin-5-one;hydrochloride is Cl.NC1=NCCCC1=O.
What is the InChIKey of 6-amino-3,4-dihydro-2H-pyridin-5-one;hydrochloride?
The InChIKey is JBAJCYVBUIBSFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2O.ClH/c6-5-4(8)2-1-3-7-5;/h1-3H2,(H2,6,7);1H.
What are the key properties of 6-amino-3,4-dihydro-2H-pyridin-5-one;hydrochloride?
6-amino-3,4-dihydro-2H-pyridin-5-one;hydrochloride has a molecular weight of 148.59 g/mol, XLogP of 0.13, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-3,4-dihydro-2H-pyridin-5-one;hydrochloride is sourced from PubChem (CID 18428532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).