(3R)-1-(quinoline-2-carbonyl)piperidine-3-carboxylic acid

C16H16N2O3 — CID 30121810

IUPAC(3R)-1-(quinoline-2-carbonyl)piperidine-3-carboxylic acid
SMILESO=C(O)[C@@H]1CCCN(C(=O)c2ccc3ccccc3n2)C1
InChIInChI=1S/C16H16N2O3/c19-15(18-9-3-5-12(10-18)16(20)21)14-8-7-11-4-1-2-6-13(11)17-14/h1-2,4,6-8,12H,3,5,9-10H2,(H,20,21)/t12-/m1/s1
InChIKeyWMQUQOSNESQFHS-GFCCVEGCSA-N
MW284.31 g/mol
LogP2.17
Rot. Bonds2

About (3R)-1-(quinoline-2-carbonyl)piperidine-3-carboxylic acid

(3R)-1-(quinoline-2-carbonyl)piperidine-3-carboxylic acid (PubChem CID 30121810) has the molecular formula C16H16N2O3 and a molecular weight of 284.31 g/mol. Its IUPAC name is (3R)-1-(quinoline-2-carbonyl)piperidine-3-carboxylic acid.

Molecular Properties

Compound Name(3R)-1-(quinoline-2-carbonyl)piperidine-3-carboxylic acid
PubChem CID30121810
Molecular FormulaC16H16N2O3
Molecular Weight284.31 g/mol
Exact Mass284.12
IUPAC Name(3R)-1-(quinoline-2-carbonyl)piperidine-3-carboxylic acid
SMILESO=C(O)[C@@H]1CCCN(C(=O)c2ccc3ccccc3n2)C1
InChIInChI=1S/C16H16N2O3/c19-15(18-9-3-5-12(10-18)16(20)21)14-8-7-11-4-1-2-6-13(11)17-14/h1-2,4,6-8,12H,3,5,9-10H2,(H,20,21)/t12-/m1/s1
InChIKeyWMQUQOSNESQFHS-GFCCVEGCSA-N
XLogP2.17
TPSA70.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.31
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (3R)-1-(quinoline-2-carbonyl)piperidine-3-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(quinoline-2-carbonyl)piperidine-3-carboxylic acid
CID 16792484
azepan-1-yl(quinolin-2-yl)methanone
CID 7779308
(3-phenylazepan-1-yl)-quinolin-2-ylmethanone
CID 90608386
[(3R)-3-aminopiperidin-1-yl]-quinolin-2-ylmethanone
CID 102978482
(3R)-1-(6-bromopyridine-2-carbonyl)piperidine-3-carboxylic acid
CID 114037544
quinolin-2-yl-[3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)piperidin-1-yl]methanone
CID 55488062
(4-amino-3-methylpiperidin-1-yl)-quinolin-2-ylmethanone
CID 79868417
(3-pyrazin-2-ylpiperidin-1-yl)-quinolin-2-ylmethanone
CID 127246090
[(3R)-3-pyrazin-2-ylpiperidin-1-yl]-quinolin-2-ylmethanone
CID 124964601
[(3R,5R)-3,5-dimethylpiperidin-1-yl]-quinolin-2-ylmethanone
CID 40744893
1-(imidazo[1,2-a]pyridine-2-carbonyl)piperidine-3-carboxylic acid
CID 43355877
[(3R)-3-(5-methyl-1H-imidazol-2-yl)piperidin-1-yl]-quinolin-2-ylmethanone
CID 124942397

Frequently Asked Questions

What is the IUPAC name of (3R)-1-(quinoline-2-carbonyl)piperidine-3-carboxylic acid?
The IUPAC name of (3R)-1-(quinoline-2-carbonyl)piperidine-3-carboxylic acid (CID 30121810) is (3R)-1-(quinoline-2-carbonyl)piperidine-3-carboxylic acid.
What is the SMILES notation for (3R)-1-(quinoline-2-carbonyl)piperidine-3-carboxylic acid?
The canonical SMILES for (3R)-1-(quinoline-2-carbonyl)piperidine-3-carboxylic acid is O=C(O)[C@@H]1CCCN(C(=O)c2ccc3ccccc3n2)C1.
What is the InChIKey of (3R)-1-(quinoline-2-carbonyl)piperidine-3-carboxylic acid?
The InChIKey is WMQUQOSNESQFHS-GFCCVEGCSA-N. The full InChI is InChI=1S/C16H16N2O3/c19-15(18-9-3-5-12(10-18)16(20)21)14-8-7-11-4-1-2-6-13(11)17-14/h1-2,4,6-8,12H,3,5,9-10H2,(H,20,21)/t12-/m1/s1.
What are the key properties of (3R)-1-(quinoline-2-carbonyl)piperidine-3-carboxylic acid?
(3R)-1-(quinoline-2-carbonyl)piperidine-3-carboxylic acid has a molecular weight of 284.31 g/mol, XLogP of 2.17, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-(quinoline-2-carbonyl)piperidine-3-carboxylic acid is sourced from PubChem (CID 30121810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).