N-[2-[1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-2-oxo-1H-quinoline-4-carboxamide

C20H26N4O3 — CID 72877016

IUPACN-[2-[1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-2-oxo-1H-quinoline-4-carboxamide
SMILESCN(C)CCN1C(=O)CCC1CCNC(=O)c1cc(=O)[nH]c2ccccc12
InChIInChI=1S/C20H26N4O3/c1-23(2)11-12-24-14(7-8-19(24)26)9-10-21-20(27)16-13-18(25)22-17-6-4-3-5-15(16)17/h3-6,13-14H,7-12H2,1-2H3,(H,21,27)(H,22,25)
InChIKeyDWDULSWIPBNBJA-UHFFFAOYSA-N
MW370.45 g/mol
LogP1.20
Rot. Bonds7

About N-[2-[1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-2-oxo-1H-quinoline-4-carboxamide

N-[2-[1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-2-oxo-1H-quinoline-4-carboxamide (PubChem CID 72877016) has the molecular formula C20H26N4O3 and a molecular weight of 370.45 g/mol. Its IUPAC name is N-[2-[1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-2-oxo-1H-quinoline-4-carboxamide.

Molecular Properties

Compound NameN-[2-[1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-2-oxo-1H-quinoline-4-carboxamide
PubChem CID72877016
Molecular FormulaC20H26N4O3
Molecular Weight370.45 g/mol
Exact Mass370.20
IUPAC NameN-[2-[1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-2-oxo-1H-quinoline-4-carboxamide
SMILESCN(C)CCN1C(=O)CCC1CCNC(=O)c1cc(=O)[nH]c2ccccc12
InChIInChI=1S/C20H26N4O3/c1-23(2)11-12-24-14(7-8-19(24)26)9-10-21-20(27)16-13-18(25)22-17-6-4-3-5-15(16)17/h3-6,13-14H,7-12H2,1-2H3,(H,21,27)(H,22,25)
InChIKeyDWDULSWIPBNBJA-UHFFFAOYSA-N
XLogP1.20
TPSA85.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.45
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[2-[1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-2-oxo-1H-quinoline-4-carboxamide 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

N-[2-[1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-2-methoxybenzamide
CID 118791949
N-[3-(dimethylamino)propyl]-2-oxo-1H-quinoline-4-carboxamide
CID 110694434
N-[2-[(2R)-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-2,4-difluorobenzamide
CID 125171691
N-[2-[(2S)-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide
CID 97118333
5-chloro-N-[2-[1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]pyridine-2-carboxamide
CID 118782633
3-chloro-N-[2-[1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-4-hydroxybenzamide
CID 91832374
N-[2-[(2S)-2-methylpiperidin-1-yl]ethyl]-2-oxo-1H-quinoline-4-carboxamide
CID 51949127
2-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-1H-quinoline-4-carboxamide
CID 42992469
N-[2-[1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-6-methoxypyridine-3-carboxamide
CID 118782972
N-[2-[(2S)-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-6-methoxypyridine-3-carboxamide
CID 125165325
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[2-[(2R)-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]urea
CID 97433822
N-[2-[(3S)-3-(2-methylphenyl)pyrrolidin-1-yl]ethyl]-2-oxo-1H-quinoline-4-carboxamide
CID 97116888

Frequently Asked Questions

What is the IUPAC name of N-[2-[1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-2-oxo-1H-quinoline-4-carboxamide?
The IUPAC name of N-[2-[1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-2-oxo-1H-quinoline-4-carboxamide (CID 72877016) is N-[2-[1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-2-oxo-1H-quinoline-4-carboxamide.
What is the SMILES notation for N-[2-[1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-2-oxo-1H-quinoline-4-carboxamide?
The canonical SMILES for N-[2-[1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-2-oxo-1H-quinoline-4-carboxamide is CN(C)CCN1C(=O)CCC1CCNC(=O)c1cc(=O)[nH]c2ccccc12.
What is the InChIKey of N-[2-[1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-2-oxo-1H-quinoline-4-carboxamide?
The InChIKey is DWDULSWIPBNBJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O3/c1-23(2)11-12-24-14(7-8-19(24)26)9-10-21-20(27)16-13-18(25)22-17-6-4-3-5-15(16)17/h3-6,13-14H,7-12H2,1-2H3,(H,21,27)(H,22,25).
What are the key properties of N-[2-[1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-2-oxo-1H-quinoline-4-carboxamide?
N-[2-[1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-2-oxo-1H-quinoline-4-carboxamide has a molecular weight of 370.45 g/mol, XLogP of 1.20, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[1-[2-(dimethylamino)ethyl]-5-oxopyrrolidin-2-yl]ethyl]-2-oxo-1H-quinoline-4-carboxamide is sourced from PubChem (CID 72877016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).