6-methoxy-3-(piperidine-1-carbonyl)-1H-quinolin-4-one

C16H18N2O3 — CID 652090

IUPAC6-methoxy-3-(piperidine-1-carbonyl)-1H-quinolin-4-one
SMILESCOc1ccc2[nH]cc(C(=O)N3CCCCC3)c(=O)c2c1
InChIInChI=1S/C16H18N2O3/c1-21-11-5-6-14-12(9-11)15(19)13(10-17-14)16(20)18-7-3-2-4-8-18/h5-6,9-10H,2-4,7-8H2,1H3,(H,17,19)
InChIKeyWEQSRNMOVTVUFX-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.16
Rot. Bonds2

About 6-methoxy-3-(piperidine-1-carbonyl)-1H-quinolin-4-one

6-methoxy-3-(piperidine-1-carbonyl)-1H-quinolin-4-one (PubChem CID 652090) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is 6-methoxy-3-(piperidine-1-carbonyl)-1H-quinolin-4-one.

Molecular Properties

Compound Name6-methoxy-3-(piperidine-1-carbonyl)-1H-quinolin-4-one
PubChem CID652090
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC Name6-methoxy-3-(piperidine-1-carbonyl)-1H-quinolin-4-one
SMILESCOc1ccc2[nH]cc(C(=O)N3CCCCC3)c(=O)c2c1
InChIInChI=1S/C16H18N2O3/c1-21-11-5-6-14-12(9-11)15(19)13(10-17-14)16(20)18-7-3-2-4-8-18/h5-6,9-10H,2-4,7-8H2,1H3,(H,17,19)
InChIKeyWEQSRNMOVTVUFX-UHFFFAOYSA-N
XLogP2.16
TPSA62.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-3-(piperidine-1-carbonyl)-1H-quinolin-4-one?
The IUPAC name of 6-methoxy-3-(piperidine-1-carbonyl)-1H-quinolin-4-one (CID 652090) is 6-methoxy-3-(piperidine-1-carbonyl)-1H-quinolin-4-one.
What is the SMILES notation for 6-methoxy-3-(piperidine-1-carbonyl)-1H-quinolin-4-one?
The canonical SMILES for 6-methoxy-3-(piperidine-1-carbonyl)-1H-quinolin-4-one is COc1ccc2[nH]cc(C(=O)N3CCCCC3)c(=O)c2c1.
What is the InChIKey of 6-methoxy-3-(piperidine-1-carbonyl)-1H-quinolin-4-one?
The InChIKey is WEQSRNMOVTVUFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-21-11-5-6-14-12(9-11)15(19)13(10-17-14)16(20)18-7-3-2-4-8-18/h5-6,9-10H,2-4,7-8H2,1H3,(H,17,19).
What are the key properties of 6-methoxy-3-(piperidine-1-carbonyl)-1H-quinolin-4-one?
6-methoxy-3-(piperidine-1-carbonyl)-1H-quinolin-4-one has a molecular weight of 286.33 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-3-(piperidine-1-carbonyl)-1H-quinolin-4-one is sourced from PubChem (CID 652090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).