1-piperidin-4-ylpyridin-2-one;dihydrochloride

C10H16Cl2N2O — CID 138991841

IUPAC1-piperidin-4-ylpyridin-2-one;dihydrochloride
SMILESCl.Cl.O=c1ccccn1C1CCNCC1
InChIInChI=1S/C10H14N2O.2ClH/c13-10-3-1-2-8-12(10)9-4-6-11-7-5-9;;/h1-3,8-9,11H,4-7H2;2*1H
InChIKeyGABKKGYCEHJYHO-UHFFFAOYSA-N
MW251.16 g/mol
LogP1.62
Rot. Bonds1

About 1-piperidin-4-ylpyridin-2-one;dihydrochloride

1-piperidin-4-ylpyridin-2-one;dihydrochloride (PubChem CID 138991841) has the molecular formula C10H16Cl2N2O and a molecular weight of 251.16 g/mol. Its IUPAC name is 1-piperidin-4-ylpyridin-2-one;dihydrochloride.

Molecular Properties

Compound Name1-piperidin-4-ylpyridin-2-one;dihydrochloride
PubChem CID138991841
Molecular FormulaC10H16Cl2N2O
Molecular Weight251.16 g/mol
Exact Mass250.06
IUPAC Name1-piperidin-4-ylpyridin-2-one;dihydrochloride
SMILESCl.Cl.O=c1ccccn1C1CCNCC1
InChIInChI=1S/C10H14N2O.2ClH/c13-10-3-1-2-8-12(10)9-4-6-11-7-5-9;;/h1-3,8-9,11H,4-7H2;2*1H
InChIKeyGABKKGYCEHJYHO-UHFFFAOYSA-N
XLogP1.62
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.16
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(piperidin-4-ylmethyl)pyridin-2(1H)-one
CID 44410571
1-(piperidin-3-ylmethyl)pyridin-2(1H)-one
CID 44410533
1-(3-Piperidin-2-ylpropyl)pyridin-2-one
CID 44535154
1-(2-(Piperazin-1-yl)ethyl)-1,2-dihydropyridin-2-one dihydrochloride
CID 12704872
Piperidinomethyl pyridone
CID 59117160
1-(2-methylpropyl)-2-oxo-N-piperidin-4-ylpyridine-3-carboxamide
CID 177665727
1-(Piperidin-4-yl)pyridin-2(1h)-one
CID 68690104
3-Amino-5-fluoro-1-piperidin-4-ylpyridin-2-one
CID 137450147
1-[(3S,4S)-3-fluoro-1-methylpiperidin-4-yl]-3-(propan-2-ylamino)pyridin-2-one
CID 137457236
1-[(3R,4S)-3-fluoro-1-methylpiperidin-4-yl]-3-(propan-2-ylamino)pyridin-2-one
CID 137457238
1-[(3S,4R)-3-fluoro-1-methylpiperidin-4-yl]-3-(propan-2-ylamino)pyridin-2-one
CID 139373429
1-[1-(2-Fluoroethyl)piperidin-4-yl]-3-(propan-2-ylamino)pyridin-2-one
CID 139383750

Frequently Asked Questions

What is the IUPAC name of 1-piperidin-4-ylpyridin-2-one;dihydrochloride?
The IUPAC name of 1-piperidin-4-ylpyridin-2-one;dihydrochloride (CID 138991841) is 1-piperidin-4-ylpyridin-2-one;dihydrochloride.
What is the SMILES notation for 1-piperidin-4-ylpyridin-2-one;dihydrochloride?
The canonical SMILES for 1-piperidin-4-ylpyridin-2-one;dihydrochloride is Cl.Cl.O=c1ccccn1C1CCNCC1.
What is the InChIKey of 1-piperidin-4-ylpyridin-2-one;dihydrochloride?
The InChIKey is GABKKGYCEHJYHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O.2ClH/c13-10-3-1-2-8-12(10)9-4-6-11-7-5-9;;/h1-3,8-9,11H,4-7H2;2*1H.
What are the key properties of 1-piperidin-4-ylpyridin-2-one;dihydrochloride?
1-piperidin-4-ylpyridin-2-one;dihydrochloride has a molecular weight of 251.16 g/mol, XLogP of 1.62, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperidin-4-ylpyridin-2-one;dihydrochloride is sourced from PubChem (CID 138991841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).