3-piperidin-4-yl-1H-quinolin-2-one;hydrochloride

C14H17ClN2O — CID 67317662

IUPAC3-piperidin-4-yl-1H-quinolin-2-one;hydrochloride
SMILESCl.O=c1[nH]c2ccccc2cc1C1CCNCC1
InChIInChI=1S/C14H16N2O.ClH/c17-14-12(10-5-7-15-8-6-10)9-11-3-1-2-4-13(11)16-14;/h1-4,9-10,15H,5-8H2,(H,16,17);1H
InChIKeyBAPAUBKDZOEWJL-UHFFFAOYSA-N
MW264.76 g/mol
LogP2.42
Rot. Bonds1

About 3-piperidin-4-yl-1H-quinolin-2-one;hydrochloride

3-piperidin-4-yl-1H-quinolin-2-one;hydrochloride (PubChem CID 67317662) has the molecular formula C14H17ClN2O and a molecular weight of 264.76 g/mol. Its IUPAC name is 3-piperidin-4-yl-1H-quinolin-2-one;hydrochloride.

Molecular Properties

Compound Name3-piperidin-4-yl-1H-quinolin-2-one;hydrochloride
PubChem CID67317662
Molecular FormulaC14H17ClN2O
Molecular Weight264.76 g/mol
Exact Mass264.10
IUPAC Name3-piperidin-4-yl-1H-quinolin-2-one;hydrochloride
SMILESCl.O=c1[nH]c2ccccc2cc1C1CCNCC1
InChIInChI=1S/C14H16N2O.ClH/c17-14-12(10-5-7-15-8-6-10)9-11-3-1-2-4-13(11)16-14;/h1-4,9-10,15H,5-8H2,(H,16,17);1H
InChIKeyBAPAUBKDZOEWJL-UHFFFAOYSA-N
XLogP2.42
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.76
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-piperidin-4-yl-1H-quinolin-2-one;hydrochloride?
The IUPAC name of 3-piperidin-4-yl-1H-quinolin-2-one;hydrochloride (CID 67317662) is 3-piperidin-4-yl-1H-quinolin-2-one;hydrochloride.
What is the SMILES notation for 3-piperidin-4-yl-1H-quinolin-2-one;hydrochloride?
The canonical SMILES for 3-piperidin-4-yl-1H-quinolin-2-one;hydrochloride is Cl.O=c1[nH]c2ccccc2cc1C1CCNCC1.
What is the InChIKey of 3-piperidin-4-yl-1H-quinolin-2-one;hydrochloride?
The InChIKey is BAPAUBKDZOEWJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O.ClH/c17-14-12(10-5-7-15-8-6-10)9-11-3-1-2-4-13(11)16-14;/h1-4,9-10,15H,5-8H2,(H,16,17);1H.
What are the key properties of 3-piperidin-4-yl-1H-quinolin-2-one;hydrochloride?
3-piperidin-4-yl-1H-quinolin-2-one;hydrochloride has a molecular weight of 264.76 g/mol, XLogP of 2.42, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-4-yl-1H-quinolin-2-one;hydrochloride is sourced from PubChem (CID 67317662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).