4-(4-chloroquinolin-7-yl)oxypiperidine-1-carboxylic acid

C15H15ClN2O3 — CID 174166454

IUPAC4-(4-chloroquinolin-7-yl)oxypiperidine-1-carboxylic acid
SMILESO=C(O)N1CCC(Oc2ccc3c(Cl)ccnc3c2)CC1
InChIInChI=1S/C15H15ClN2O3/c16-13-3-6-17-14-9-11(1-2-12(13)14)21-10-4-7-18(8-5-10)15(19)20/h1-3,6,9-10H,4-5,7-8H2,(H,19,20)
InChIKeyROAXYZHLTKWGSR-UHFFFAOYSA-N
MW306.75 g/mol
LogP3.41
Rot. Bonds2

About 4-(4-chloroquinolin-7-yl)oxypiperidine-1-carboxylic acid

4-(4-chloroquinolin-7-yl)oxypiperidine-1-carboxylic acid (PubChem CID 174166454) has the molecular formula C15H15ClN2O3 and a molecular weight of 306.75 g/mol. Its IUPAC name is 4-(4-chloroquinolin-7-yl)oxypiperidine-1-carboxylic acid.

Molecular Properties

Compound Name4-(4-chloroquinolin-7-yl)oxypiperidine-1-carboxylic acid
PubChem CID174166454
Molecular FormulaC15H15ClN2O3
Molecular Weight306.75 g/mol
Exact Mass306.08
IUPAC Name4-(4-chloroquinolin-7-yl)oxypiperidine-1-carboxylic acid
SMILESO=C(O)N1CCC(Oc2ccc3c(Cl)ccnc3c2)CC1
InChIInChI=1S/C15H15ClN2O3/c16-13-3-6-17-14-9-11(1-2-12(13)14)21-10-4-7-18(8-5-10)15(19)20/h1-3,6,9-10H,4-5,7-8H2,(H,19,20)
InChIKeyROAXYZHLTKWGSR-UHFFFAOYSA-N
XLogP3.41
TPSA62.66 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.75
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-chloroquinolin-6-yl)oxypiperidine-1-carboxylic acid
CID 121318195
4-(4-chloro-3-hydroxyphenoxy)piperidine-1-carboxylic acid
CID 135387758
4-[7-(1-methylpiperidin-4-yl)oxyquinazolin-4-yl]piperidine-1-carboxylic acid
CID 69260348
4-(3-chlorophenoxy)piperidine-1-carboxylic acid
CID 22353407
4-naphthalen-2-yloxypiperidine-1-carboxylic acid
CID 18423340
4-(6-iodoquinolin-4-yl)oxypiperidine-1-carboxylic acid
CID 69468516
[4-(4-chlorophenoxy)piperidin-1-yl]-(1,6-naphthyridin-5-yl)methanone
CID 67168369
4-(4-pyridin-4-yloxycyclohexyl)oxypiperidine-1-carboxylic acid
CID 123525099
2-(4-chloroquinolin-7-yl)oxyethyl-methylcarbamic acid
CID 174166475
4-[(2-oxo-1H-pyridin-4-yl)oxy]piperidine-1-carboxylic acid
CID 91402575
[4-(4-chlorophenoxy)piperidin-1-yl]-(3-chloro-2-pyridinyl)methanone
CID 166335688
2-[4-(4-chlorophenoxy)piperidin-1-yl]-2-oxoacetic acid
CID 69100024

Frequently Asked Questions

What is the IUPAC name of 4-(4-chloroquinolin-7-yl)oxypiperidine-1-carboxylic acid?
The IUPAC name of 4-(4-chloroquinolin-7-yl)oxypiperidine-1-carboxylic acid (CID 174166454) is 4-(4-chloroquinolin-7-yl)oxypiperidine-1-carboxylic acid.
What is the SMILES notation for 4-(4-chloroquinolin-7-yl)oxypiperidine-1-carboxylic acid?
The canonical SMILES for 4-(4-chloroquinolin-7-yl)oxypiperidine-1-carboxylic acid is O=C(O)N1CCC(Oc2ccc3c(Cl)ccnc3c2)CC1.
What is the InChIKey of 4-(4-chloroquinolin-7-yl)oxypiperidine-1-carboxylic acid?
The InChIKey is ROAXYZHLTKWGSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O3/c16-13-3-6-17-14-9-11(1-2-12(13)14)21-10-4-7-18(8-5-10)15(19)20/h1-3,6,9-10H,4-5,7-8H2,(H,19,20).
What are the key properties of 4-(4-chloroquinolin-7-yl)oxypiperidine-1-carboxylic acid?
4-(4-chloroquinolin-7-yl)oxypiperidine-1-carboxylic acid has a molecular weight of 306.75 g/mol, XLogP of 3.41, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-chloroquinolin-7-yl)oxypiperidine-1-carboxylic acid is sourced from PubChem (CID 174166454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).