(2,6-dimethylpiperidin-1-yl)-(2-phenylquinolin-4-yl)methanone

C23H24N2O — CID 4224556

IUPAC(2,6-dimethylpiperidin-1-yl)-(2-phenylquinolin-4-yl)methanone
SMILESCC1CCCC(C)N1C(=O)c1cc(-c2ccccc2)nc2ccccc12
InChIInChI=1S/C23H24N2O/c1-16-9-8-10-17(2)25(16)23(26)20-15-22(18-11-4-3-5-12-18)24-21-14-7-6-13-19(20)21/h3-7,11-17H,8-10H2,1-2H3
InChIKeyAUHUUWJMHOMVJH-UHFFFAOYSA-N
MW344.46 g/mol
LogP5.30
Rot. Bonds2

About (2,6-dimethylpiperidin-1-yl)-(2-phenylquinolin-4-yl)methanone

(2,6-dimethylpiperidin-1-yl)-(2-phenylquinolin-4-yl)methanone (PubChem CID 4224556) has the molecular formula C23H24N2O and a molecular weight of 344.46 g/mol. Its IUPAC name is (2,6-dimethylpiperidin-1-yl)-(2-phenylquinolin-4-yl)methanone.

Molecular Properties

Compound Name(2,6-dimethylpiperidin-1-yl)-(2-phenylquinolin-4-yl)methanone
PubChem CID4224556
Molecular FormulaC23H24N2O
Molecular Weight344.46 g/mol
Exact Mass344.19
IUPAC Name(2,6-dimethylpiperidin-1-yl)-(2-phenylquinolin-4-yl)methanone
SMILESCC1CCCC(C)N1C(=O)c1cc(-c2ccccc2)nc2ccccc12
InChIInChI=1S/C23H24N2O/c1-16-9-8-10-17(2)25(16)23(26)20-15-22(18-11-4-3-5-12-18)24-21-14-7-6-13-19(20)21/h3-7,11-17H,8-10H2,1-2H3
InChIKeyAUHUUWJMHOMVJH-UHFFFAOYSA-N
XLogP5.30
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.46
LogP ≤ 55.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

[(2R,6S)-2,6-dimethylpiperidin-1-yl]-[2-(2-methylphenyl)quinolin-4-yl]methanone
CID 1220326
(2-chloroquinolin-4-yl)-(2,6-dimethylpiperidin-1-yl)methanone
CID 43319697
[(2R)-1-[(2S,6S)-2,6-dimethylpiperidin-1-yl]-1-oxopropan-2-yl] 2-phenylquinoline-4-carboxylate
CID 7866923
[2-(4-bromophenyl)quinolin-4-yl]-(2-methylpiperidin-1-yl)methanone
CID 4198467
(2,6-dimethylmorpholin-4-yl)-(2-phenylquinolin-4-yl)methanone
CID 2873550
(2,6-dimethylpiperidin-1-yl)-(5,7-diphenylpyrazolo[1,5-a]pyrimidin-3-yl)methanone
CID 4118984
bis(cyclopentane);bis(2-phenylquinoline-4-carboxylic acid);titanium(2+)
CID 135850214
[2-(3,4-dimethylphenyl)quinolin-4-yl]-[(2R)-2-methylpiperidin-1-yl]methanone
CID 1221554
N,N-dicyclohexyl-2-phenylquinoline-4-carboxamide
CID 3554949
[4-[2-(4-methoxyphenyl)quinoline-4-carbonyl]-2,5-dimethylpiperazin-1-yl]-[2-(4-methoxyphenyl)quinolin-4-yl]methanone
CID 4605822
1-(2-phenylquinoline-4-carbonyl)piperidine-3-carboxylic acid
CID 133108166
N-(2,3-dimethylcyclohexyl)-2-phenylquinoline-4-carboxamide
CID 5141902

Frequently Asked Questions

What is the IUPAC name of (2,6-dimethylpiperidin-1-yl)-(2-phenylquinolin-4-yl)methanone?
The IUPAC name of (2,6-dimethylpiperidin-1-yl)-(2-phenylquinolin-4-yl)methanone (CID 4224556) is (2,6-dimethylpiperidin-1-yl)-(2-phenylquinolin-4-yl)methanone.
What is the SMILES notation for (2,6-dimethylpiperidin-1-yl)-(2-phenylquinolin-4-yl)methanone?
The canonical SMILES for (2,6-dimethylpiperidin-1-yl)-(2-phenylquinolin-4-yl)methanone is CC1CCCC(C)N1C(=O)c1cc(-c2ccccc2)nc2ccccc12.
What is the InChIKey of (2,6-dimethylpiperidin-1-yl)-(2-phenylquinolin-4-yl)methanone?
The InChIKey is AUHUUWJMHOMVJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O/c1-16-9-8-10-17(2)25(16)23(26)20-15-22(18-11-4-3-5-12-18)24-21-14-7-6-13-19(20)21/h3-7,11-17H,8-10H2,1-2H3.
What are the key properties of (2,6-dimethylpiperidin-1-yl)-(2-phenylquinolin-4-yl)methanone?
(2,6-dimethylpiperidin-1-yl)-(2-phenylquinolin-4-yl)methanone has a molecular weight of 344.46 g/mol, XLogP of 5.30, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dimethylpiperidin-1-yl)-(2-phenylquinolin-4-yl)methanone is sourced from PubChem (CID 4224556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).