N-methyl-2-[2-oxo-4-(piperidine-1-carbonyl)quinolin-1-yl]-N-phenylacetamide

C24H25N3O3 — CID 51369709

IUPACN-methyl-2-[2-oxo-4-(piperidine-1-carbonyl)quinolin-1-yl]-N-phenylacetamide
SMILESCN(C(=O)Cn1c(=O)cc(C(=O)N2CCCCC2)c2ccccc21)c1ccccc1
InChIInChI=1S/C24H25N3O3/c1-25(18-10-4-2-5-11-18)23(29)17-27-21-13-7-6-12-19(21)20(16-22(27)28)24(30)26-14-8-3-9-15-26/h2,4-7,10-13,16H,3,8-9,14-15,17H2,1H3
InChIKeyQHRRQJLNHBWXBE-UHFFFAOYSA-N
MW403.48 g/mol
LogP3.29
Rot. Bonds4

About N-methyl-2-[2-oxo-4-(piperidine-1-carbonyl)quinolin-1-yl]-N-phenylacetamide

N-methyl-2-[2-oxo-4-(piperidine-1-carbonyl)quinolin-1-yl]-N-phenylacetamide (PubChem CID 51369709) has the molecular formula C24H25N3O3 and a molecular weight of 403.48 g/mol. Its IUPAC name is N-methyl-2-[2-oxo-4-(piperidine-1-carbonyl)quinolin-1-yl]-N-phenylacetamide.

Molecular Properties

Compound NameN-methyl-2-[2-oxo-4-(piperidine-1-carbonyl)quinolin-1-yl]-N-phenylacetamide
PubChem CID51369709
Molecular FormulaC24H25N3O3
Molecular Weight403.48 g/mol
Exact Mass403.19
IUPAC NameN-methyl-2-[2-oxo-4-(piperidine-1-carbonyl)quinolin-1-yl]-N-phenylacetamide
SMILESCN(C(=O)Cn1c(=O)cc(C(=O)N2CCCCC2)c2ccccc21)c1ccccc1
InChIInChI=1S/C24H25N3O3/c1-25(18-10-4-2-5-11-18)23(29)17-27-21-13-7-6-12-19(21)20(16-22(27)28)24(30)26-14-8-3-9-15-26/h2,4-7,10-13,16H,3,8-9,14-15,17H2,1H3
InChIKeyQHRRQJLNHBWXBE-UHFFFAOYSA-N
XLogP3.29
TPSA62.62 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.48
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[2-oxo-4-(piperidine-1-carbonyl)quinolin-1-yl]-N-phenylacetamide?
The IUPAC name of N-methyl-2-[2-oxo-4-(piperidine-1-carbonyl)quinolin-1-yl]-N-phenylacetamide (CID 51369709) is N-methyl-2-[2-oxo-4-(piperidine-1-carbonyl)quinolin-1-yl]-N-phenylacetamide.
What is the SMILES notation for N-methyl-2-[2-oxo-4-(piperidine-1-carbonyl)quinolin-1-yl]-N-phenylacetamide?
The canonical SMILES for N-methyl-2-[2-oxo-4-(piperidine-1-carbonyl)quinolin-1-yl]-N-phenylacetamide is CN(C(=O)Cn1c(=O)cc(C(=O)N2CCCCC2)c2ccccc21)c1ccccc1.
What is the InChIKey of N-methyl-2-[2-oxo-4-(piperidine-1-carbonyl)quinolin-1-yl]-N-phenylacetamide?
The InChIKey is QHRRQJLNHBWXBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O3/c1-25(18-10-4-2-5-11-18)23(29)17-27-21-13-7-6-12-19(21)20(16-22(27)28)24(30)26-14-8-3-9-15-26/h2,4-7,10-13,16H,3,8-9,14-15,17H2,1H3.
What are the key properties of N-methyl-2-[2-oxo-4-(piperidine-1-carbonyl)quinolin-1-yl]-N-phenylacetamide?
N-methyl-2-[2-oxo-4-(piperidine-1-carbonyl)quinolin-1-yl]-N-phenylacetamide has a molecular weight of 403.48 g/mol, XLogP of 3.29, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[2-oxo-4-(piperidine-1-carbonyl)quinolin-1-yl]-N-phenylacetamide is sourced from PubChem (CID 51369709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).