phenyl-[(2R)-2-quinolin-6-ylpiperidin-1-yl]methanone

C21H20N2O — CID 124501089

IUPACphenyl-[(2R)-2-quinolin-6-ylpiperidin-1-yl]methanone
SMILESO=C(c1ccccc1)N1CCCC[C@@H]1c1ccc2ncccc2c1
InChIInChI=1S/C21H20N2O/c24-21(16-7-2-1-3-8-16)23-14-5-4-10-20(23)18-11-12-19-17(15-18)9-6-13-22-19/h1-3,6-9,11-13,15,20H,4-5,10,14H2/t20-/m1/s1
InChIKeyURUKIFPUDASLAD-HXUWFJFHSA-N
MW316.40 g/mol
LogP4.60
Rot. Bonds2

About phenyl-[(2R)-2-quinolin-6-ylpiperidin-1-yl]methanone

phenyl-[(2R)-2-quinolin-6-ylpiperidin-1-yl]methanone (PubChem CID 124501089) has the molecular formula C21H20N2O and a molecular weight of 316.40 g/mol. Its IUPAC name is phenyl-[(2R)-2-quinolin-6-ylpiperidin-1-yl]methanone.

Molecular Properties

Compound Namephenyl-[(2R)-2-quinolin-6-ylpiperidin-1-yl]methanone
PubChem CID124501089
Molecular FormulaC21H20N2O
Molecular Weight316.40 g/mol
Exact Mass316.16
IUPAC Namephenyl-[(2R)-2-quinolin-6-ylpiperidin-1-yl]methanone
SMILESO=C(c1ccccc1)N1CCCC[C@@H]1c1ccc2ncccc2c1
InChIInChI=1S/C21H20N2O/c24-21(16-7-2-1-3-8-16)23-14-5-4-10-20(23)18-11-12-19-17(15-18)9-6-13-22-19/h1-3,6-9,11-13,15,20H,4-5,10,14H2/t20-/m1/s1
InChIKeyURUKIFPUDASLAD-HXUWFJFHSA-N
XLogP4.60
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.40
LogP ≤ 54.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze phenyl-[(2R)-2-quinolin-6-ylpiperidin-1-yl]methanone 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

phenyl-[(2R)-2-quinolin-3-ylpyrrolidin-1-yl]methanone
CID 124500188
tert-butyl 2-quinolin-6-ylpiperidine-1-carboxylate
CID 102544437
6-(1-phenylpyrrolidin-2-yl)quinoline
CID 138973287
phenyl-[2-(2-piperidin-1-yl-3-pyridinyl)piperidin-1-yl]methanone
CID 102541555
6-(1-ethylpiperidin-2-yl)quinoline
CID 102544431
[2-[6-(cyclopropylamino)-3-pyridinyl]piperidin-1-yl]-phenylmethanone
CID 102540373
[(2R)-2-[2-(methylamino)-4-pyridinyl]pyrrolidin-1-yl]-phenylmethanone
CID 125001597
[2-(1-aminoethyl)piperidin-1-yl]-quinolin-6-ylmethanone;dihydrochloride
CID 119437061
[2-(2-anilino-3-pyridinyl)piperidin-1-yl]-phenylmethanone
CID 102540565
[2-(furan-3-yl)piperidin-1-yl]-phenylmethanone
CID 102544350
[2-[6-(dimethylamino)-3-pyridinyl]pyrrolidin-1-yl]-phenylmethanone
CID 102539784
[2-[2-methyl-6-(methylamino)pyrimidin-4-yl]pyrrolidin-1-yl]-quinolin-6-ylmethanone
CID 110113668

Frequently Asked Questions

What is the IUPAC name of phenyl-[(2R)-2-quinolin-6-ylpiperidin-1-yl]methanone?
The IUPAC name of phenyl-[(2R)-2-quinolin-6-ylpiperidin-1-yl]methanone (CID 124501089) is phenyl-[(2R)-2-quinolin-6-ylpiperidin-1-yl]methanone.
What is the SMILES notation for phenyl-[(2R)-2-quinolin-6-ylpiperidin-1-yl]methanone?
The canonical SMILES for phenyl-[(2R)-2-quinolin-6-ylpiperidin-1-yl]methanone is O=C(c1ccccc1)N1CCCC[C@@H]1c1ccc2ncccc2c1.
What is the InChIKey of phenyl-[(2R)-2-quinolin-6-ylpiperidin-1-yl]methanone?
The InChIKey is URUKIFPUDASLAD-HXUWFJFHSA-N. The full InChI is InChI=1S/C21H20N2O/c24-21(16-7-2-1-3-8-16)23-14-5-4-10-20(23)18-11-12-19-17(15-18)9-6-13-22-19/h1-3,6-9,11-13,15,20H,4-5,10,14H2/t20-/m1/s1.
What are the key properties of phenyl-[(2R)-2-quinolin-6-ylpiperidin-1-yl]methanone?
phenyl-[(2R)-2-quinolin-6-ylpiperidin-1-yl]methanone has a molecular weight of 316.40 g/mol, XLogP of 4.60, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl-[(2R)-2-quinolin-6-ylpiperidin-1-yl]methanone is sourced from PubChem (CID 124501089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).