N-methyl-2-oxo-N-(2-piperidin-1-ylethyl)-3,4-dihydro-1H-quinoline-4-carboxamide

C18H25N3O2 — CID 46966420

IUPACN-methyl-2-oxo-N-(2-piperidin-1-ylethyl)-3,4-dihydro-1H-quinoline-4-carboxamide
SMILESCN(CCN1CCCCC1)C(=O)C1CC(=O)Nc2ccccc21
InChIInChI=1S/C18H25N3O2/c1-20(11-12-21-9-5-2-6-10-21)18(23)15-13-17(22)19-16-8-4-3-7-14(15)16/h3-4,7-8,15H,2,5-6,9-13H2,1H3,(H,19,22)
InChIKeyDVHHLHUZHLUMFM-UHFFFAOYSA-N
MW315.42 g/mol
LogP2.06
Rot. Bonds4

About N-methyl-2-oxo-N-(2-piperidin-1-ylethyl)-3,4-dihydro-1H-quinoline-4-carboxamide

N-methyl-2-oxo-N-(2-piperidin-1-ylethyl)-3,4-dihydro-1H-quinoline-4-carboxamide (PubChem CID 46966420) has the molecular formula C18H25N3O2 and a molecular weight of 315.42 g/mol. Its IUPAC name is N-methyl-2-oxo-N-(2-piperidin-1-ylethyl)-3,4-dihydro-1H-quinoline-4-carboxamide.

Molecular Properties

Compound NameN-methyl-2-oxo-N-(2-piperidin-1-ylethyl)-3,4-dihydro-1H-quinoline-4-carboxamide
PubChem CID46966420
Molecular FormulaC18H25N3O2
Molecular Weight315.42 g/mol
Exact Mass315.19
IUPAC NameN-methyl-2-oxo-N-(2-piperidin-1-ylethyl)-3,4-dihydro-1H-quinoline-4-carboxamide
SMILESCN(CCN1CCCCC1)C(=O)C1CC(=O)Nc2ccccc21
InChIInChI=1S/C18H25N3O2/c1-20(11-12-21-9-5-2-6-10-21)18(23)15-13-17(22)19-16-8-4-3-7-14(15)16/h3-4,7-8,15H,2,5-6,9-13H2,1H3,(H,19,22)
InChIKeyDVHHLHUZHLUMFM-UHFFFAOYSA-N
XLogP2.06
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.42
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-oxo-N-(2-piperidin-1-ylethyl)-3,4-dihydro-1H-quinoline-4-carboxamide?
The IUPAC name of N-methyl-2-oxo-N-(2-piperidin-1-ylethyl)-3,4-dihydro-1H-quinoline-4-carboxamide (CID 46966420) is N-methyl-2-oxo-N-(2-piperidin-1-ylethyl)-3,4-dihydro-1H-quinoline-4-carboxamide.
What is the SMILES notation for N-methyl-2-oxo-N-(2-piperidin-1-ylethyl)-3,4-dihydro-1H-quinoline-4-carboxamide?
The canonical SMILES for N-methyl-2-oxo-N-(2-piperidin-1-ylethyl)-3,4-dihydro-1H-quinoline-4-carboxamide is CN(CCN1CCCCC1)C(=O)C1CC(=O)Nc2ccccc21.
What is the InChIKey of N-methyl-2-oxo-N-(2-piperidin-1-ylethyl)-3,4-dihydro-1H-quinoline-4-carboxamide?
The InChIKey is DVHHLHUZHLUMFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O2/c1-20(11-12-21-9-5-2-6-10-21)18(23)15-13-17(22)19-16-8-4-3-7-14(15)16/h3-4,7-8,15H,2,5-6,9-13H2,1H3,(H,19,22).
What are the key properties of N-methyl-2-oxo-N-(2-piperidin-1-ylethyl)-3,4-dihydro-1H-quinoline-4-carboxamide?
N-methyl-2-oxo-N-(2-piperidin-1-ylethyl)-3,4-dihydro-1H-quinoline-4-carboxamide has a molecular weight of 315.42 g/mol, XLogP of 2.06, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-oxo-N-(2-piperidin-1-ylethyl)-3,4-dihydro-1H-quinoline-4-carboxamide is sourced from PubChem (CID 46966420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).