2-piperidin-4-ylquinoline-4-carboxylic acid

C15H16N2O2 — CID 84635932

IUPAC2-piperidin-4-ylquinoline-4-carboxylic acid
SMILESO=C(O)c1cc(C2CCNCC2)nc2ccccc12
InChIInChI=1S/C15H16N2O2/c18-15(19)12-9-14(10-5-7-16-8-6-10)17-13-4-2-1-3-11(12)13/h1-4,9-10,16H,5-8H2,(H,18,19)
InChIKeyCIHORCWLLKOFAE-UHFFFAOYSA-N
MW256.31 g/mol
LogP2.40
Rot. Bonds2

About 2-piperidin-4-ylquinoline-4-carboxylic acid

2-piperidin-4-ylquinoline-4-carboxylic acid (PubChem CID 84635932) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is 2-piperidin-4-ylquinoline-4-carboxylic acid.

Molecular Properties

Compound Name2-piperidin-4-ylquinoline-4-carboxylic acid
PubChem CID84635932
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC Name2-piperidin-4-ylquinoline-4-carboxylic acid
SMILESO=C(O)c1cc(C2CCNCC2)nc2ccccc12
InChIInChI=1S/C15H16N2O2/c18-15(19)12-9-14(10-5-7-16-8-6-10)17-13-4-2-1-3-11(12)13/h1-4,9-10,16H,5-8H2,(H,18,19)
InChIKeyCIHORCWLLKOFAE-UHFFFAOYSA-N
XLogP2.40
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-ethyl-2-piperidin-4-ylquinoline-4-carboxylic acid
CID 84643398
6-methoxy-2-piperidin-4-ylquinoline-4-carboxylic acid
CID 84643635
2-cyclopropylquinoline-4-carbonyl chloride;hydrochloride
CID 87334108
2-cyclopropyl-N-piperidin-4-yl-N-propylquinoline-4-carboxamide;dihydrochloride
CID 119824385
7-fluoro-2-pyrrolidin-3-ylquinoline-4-carboxylic acid
CID 84638041
2-cyclopentylquinoline-4-carbohydrazide
CID 5270704
(2-cyclopropylquinolin-4-yl)-(3,9-diazabicyclo[4.2.1]nonan-3-yl)methanone;dihydrochloride
CID 119636803
(2-cyclopropylquinolin-4-yl)-(2,3-dimethylpiperazin-1-yl)methanone;dihydrochloride
CID 120569385
(4-aminopiperidin-1-yl)-(2-cyclopropylquinolin-4-yl)methanone;dihydrochloride
CID 119374525
2-(3-cyclopropylpyrazol-1-yl)quinoline-4-carboxylic acid
CID 62493957
2-cyclopropyl-N-methylsulfonylquinoline-4-carboxamide
CID 146154924
2-cyclopropyl-N-(pyrrolidin-2-ylmethyl)quinoline-4-carboxamide;dihydrochloride
CID 119511849

Frequently Asked Questions

What is the IUPAC name of 2-piperidin-4-ylquinoline-4-carboxylic acid?
The IUPAC name of 2-piperidin-4-ylquinoline-4-carboxylic acid (CID 84635932) is 2-piperidin-4-ylquinoline-4-carboxylic acid.
What is the SMILES notation for 2-piperidin-4-ylquinoline-4-carboxylic acid?
The canonical SMILES for 2-piperidin-4-ylquinoline-4-carboxylic acid is O=C(O)c1cc(C2CCNCC2)nc2ccccc12.
What is the InChIKey of 2-piperidin-4-ylquinoline-4-carboxylic acid?
The InChIKey is CIHORCWLLKOFAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c18-15(19)12-9-14(10-5-7-16-8-6-10)17-13-4-2-1-3-11(12)13/h1-4,9-10,16H,5-8H2,(H,18,19).
What are the key properties of 2-piperidin-4-ylquinoline-4-carboxylic acid?
2-piperidin-4-ylquinoline-4-carboxylic acid has a molecular weight of 256.31 g/mol, XLogP of 2.40, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-4-ylquinoline-4-carboxylic acid is sourced from PubChem (CID 84635932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).