7-chloro-3-piperidin-4-yl-1H-quinolin-2-one

C14H15ClN2O — CID 53427784

IUPAC7-chloro-3-piperidin-4-yl-1H-quinolin-2-one
SMILESO=c1[nH]c2cc(Cl)ccc2cc1C1CCNCC1
InChIInChI=1S/C14H15ClN2O/c15-11-2-1-10-7-12(9-3-5-16-6-4-9)14(18)17-13(10)8-11/h1-2,7-9,16H,3-6H2,(H,17,18)
InChIKeyIMJUYPYLMBFITD-UHFFFAOYSA-N
MW262.74 g/mol
LogP2.65
Rot. Bonds1

About 7-chloro-3-piperidin-4-yl-1H-quinolin-2-one

7-chloro-3-piperidin-4-yl-1H-quinolin-2-one (PubChem CID 53427784) has the molecular formula C14H15ClN2O and a molecular weight of 262.74 g/mol. Its IUPAC name is 7-chloro-3-piperidin-4-yl-1H-quinolin-2-one.

Molecular Properties

Compound Name7-chloro-3-piperidin-4-yl-1H-quinolin-2-one
PubChem CID53427784
Molecular FormulaC14H15ClN2O
Molecular Weight262.74 g/mol
Exact Mass262.09
IUPAC Name7-chloro-3-piperidin-4-yl-1H-quinolin-2-one
SMILESO=c1[nH]c2cc(Cl)ccc2cc1C1CCNCC1
InChIInChI=1S/C14H15ClN2O/c15-11-2-1-10-7-12(9-3-5-16-6-4-9)14(18)17-13(10)8-11/h1-2,7-9,16H,3-6H2,(H,17,18)
InChIKeyIMJUYPYLMBFITD-UHFFFAOYSA-N
XLogP2.65
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.74
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-chloro-3-piperidin-4-yl-1H-quinolin-2-one?
The IUPAC name of 7-chloro-3-piperidin-4-yl-1H-quinolin-2-one (CID 53427784) is 7-chloro-3-piperidin-4-yl-1H-quinolin-2-one.
What is the SMILES notation for 7-chloro-3-piperidin-4-yl-1H-quinolin-2-one?
The canonical SMILES for 7-chloro-3-piperidin-4-yl-1H-quinolin-2-one is O=c1[nH]c2cc(Cl)ccc2cc1C1CCNCC1.
What is the InChIKey of 7-chloro-3-piperidin-4-yl-1H-quinolin-2-one?
The InChIKey is IMJUYPYLMBFITD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O/c15-11-2-1-10-7-12(9-3-5-16-6-4-9)14(18)17-13(10)8-11/h1-2,7-9,16H,3-6H2,(H,17,18).
What are the key properties of 7-chloro-3-piperidin-4-yl-1H-quinolin-2-one?
7-chloro-3-piperidin-4-yl-1H-quinolin-2-one has a molecular weight of 262.74 g/mol, XLogP of 2.65, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-3-piperidin-4-yl-1H-quinolin-2-one is sourced from PubChem (CID 53427784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).