N-methyl-2-oxo-N-pyrrolidin-3-yl-3,4-dihydro-1H-quinoline-4-carboxamide;hydrochloride

C15H20ClN3O2 — CID 119553909

IUPACN-methyl-2-oxo-N-pyrrolidin-3-yl-3,4-dihydro-1H-quinoline-4-carboxamide;hydrochloride
SMILESCN(C(=O)C1CC(=O)Nc2ccccc21)C1CCNC1.Cl
InChIInChI=1S/C15H19N3O2.ClH/c1-18(10-6-7-16-9-10)15(20)12-8-14(19)17-13-5-3-2-4-11(12)13;/h2-5,10,12,16H,6-9H2,1H3,(H,17,19);1H
InChIKeyGEOCPMHPPNTJFN-UHFFFAOYSA-N
MW309.80 g/mol
LogP1.35
Rot. Bonds2

About N-methyl-2-oxo-N-pyrrolidin-3-yl-3,4-dihydro-1H-quinoline-4-carboxamide;hydrochloride

N-methyl-2-oxo-N-pyrrolidin-3-yl-3,4-dihydro-1H-quinoline-4-carboxamide;hydrochloride (PubChem CID 119553909) has the molecular formula C15H20ClN3O2 and a molecular weight of 309.80 g/mol. Its IUPAC name is N-methyl-2-oxo-N-pyrrolidin-3-yl-3,4-dihydro-1H-quinoline-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-methyl-2-oxo-N-pyrrolidin-3-yl-3,4-dihydro-1H-quinoline-4-carboxamide;hydrochloride
PubChem CID119553909
Molecular FormulaC15H20ClN3O2
Molecular Weight309.80 g/mol
Exact Mass309.12
IUPAC NameN-methyl-2-oxo-N-pyrrolidin-3-yl-3,4-dihydro-1H-quinoline-4-carboxamide;hydrochloride
SMILESCN(C(=O)C1CC(=O)Nc2ccccc21)C1CCNC1.Cl
InChIInChI=1S/C15H19N3O2.ClH/c1-18(10-6-7-16-9-10)15(20)12-8-14(19)17-13-5-3-2-4-11(12)13;/h2-5,10,12,16H,6-9H2,1H3,(H,17,19);1H
InChIKeyGEOCPMHPPNTJFN-UHFFFAOYSA-N
XLogP1.35
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.80
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-oxo-N-pyrrolidin-3-yl-3,4-dihydro-1H-quinoline-4-carboxamide;hydrochloride?
The IUPAC name of N-methyl-2-oxo-N-pyrrolidin-3-yl-3,4-dihydro-1H-quinoline-4-carboxamide;hydrochloride (CID 119553909) is N-methyl-2-oxo-N-pyrrolidin-3-yl-3,4-dihydro-1H-quinoline-4-carboxamide;hydrochloride.
What is the SMILES notation for N-methyl-2-oxo-N-pyrrolidin-3-yl-3,4-dihydro-1H-quinoline-4-carboxamide;hydrochloride?
The canonical SMILES for N-methyl-2-oxo-N-pyrrolidin-3-yl-3,4-dihydro-1H-quinoline-4-carboxamide;hydrochloride is CN(C(=O)C1CC(=O)Nc2ccccc21)C1CCNC1.Cl.
What is the InChIKey of N-methyl-2-oxo-N-pyrrolidin-3-yl-3,4-dihydro-1H-quinoline-4-carboxamide;hydrochloride?
The InChIKey is GEOCPMHPPNTJFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2.ClH/c1-18(10-6-7-16-9-10)15(20)12-8-14(19)17-13-5-3-2-4-11(12)13;/h2-5,10,12,16H,6-9H2,1H3,(H,17,19);1H.
What are the key properties of N-methyl-2-oxo-N-pyrrolidin-3-yl-3,4-dihydro-1H-quinoline-4-carboxamide;hydrochloride?
N-methyl-2-oxo-N-pyrrolidin-3-yl-3,4-dihydro-1H-quinoline-4-carboxamide;hydrochloride has a molecular weight of 309.80 g/mol, XLogP of 1.35, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-oxo-N-pyrrolidin-3-yl-3,4-dihydro-1H-quinoline-4-carboxamide;hydrochloride is sourced from PubChem (CID 119553909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).