N-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]quinoline-2-carboxamide

C15H15N3O2 — CID 96506885

IUPACN-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]quinoline-2-carboxamide
SMILESCN1CC[C@@H](NC(=O)c2ccc3ccccc3n2)C1=O
InChIInChI=1S/C15H15N3O2/c1-18-9-8-13(15(18)20)17-14(19)12-7-6-10-4-2-3-5-11(10)16-12/h2-7,13H,8-9H2,1H3,(H,17,19)/t13-/m1/s1
InChIKeyLSOQCIPQOUTCBB-CYBMUJFWSA-N
MW269.30 g/mol
LogP1.20
Rot. Bonds2

About N-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]quinoline-2-carboxamide

N-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]quinoline-2-carboxamide (PubChem CID 96506885) has the molecular formula C15H15N3O2 and a molecular weight of 269.30 g/mol. Its IUPAC name is N-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]quinoline-2-carboxamide.

Molecular Properties

Compound NameN-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]quinoline-2-carboxamide
PubChem CID96506885
Molecular FormulaC15H15N3O2
Molecular Weight269.30 g/mol
Exact Mass269.12
IUPAC NameN-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]quinoline-2-carboxamide
SMILESCN1CC[C@@H](NC(=O)c2ccc3ccccc3n2)C1=O
InChIInChI=1S/C15H15N3O2/c1-18-9-8-13(15(18)20)17-14(19)12-7-6-10-4-2-3-5-11(10)16-12/h2-7,13H,8-9H2,1H3,(H,17,19)/t13-/m1/s1
InChIKeyLSOQCIPQOUTCBB-CYBMUJFWSA-N
XLogP1.20
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-(1-methyl-2-oxopyrrolidin-3-yl)quinoline-2-carboxamide
CID 103827378
N-(1-benzyl-2-oxopyrrolidin-3-yl)quinoline-2-carboxamide
CID 51127250
N-[(4S)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]quinoline-2-carboxamide
CID 38815166
N-(1-propan-2-ylazetidin-3-yl)quinoline-2-carboxamide
CID 100627820
N-(3-oxocyclobutyl)quinoline-2-carboxamide
CID 141469344
N-(2-aminocyclopentyl)quinoline-2-carboxamide
CID 63251270
2-(quinoline-2-carbonylamino)cyclopentane-1-carboxylic acid
CID 64814765
N-(1,2,3,4-tetrahydronaphthalen-1-yl)quinoline-2-carboxamide
CID 5135545
N-(1-methyl-2-oxopyrrolidin-3-yl)-1H-indazole-6-carboxamide
CID 106256433
N'-(cyclopropanecarbonyl)quinoline-2-carbohydrazide
CID 26798961
2-(aminomethyl)-N-(1-methyl-2-oxopyrrolidin-3-yl)-1,3-thiazole-4-carboxamide
CID 103810798
5-(4-hydroxybut-1-ynyl)-N-(1-methyl-2-oxopyrrolidin-3-yl)pyridine-2-carboxamide
CID 106258786

Frequently Asked Questions

What is the IUPAC name of N-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]quinoline-2-carboxamide?
The IUPAC name of N-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]quinoline-2-carboxamide (CID 96506885) is N-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]quinoline-2-carboxamide.
What is the SMILES notation for N-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]quinoline-2-carboxamide?
The canonical SMILES for N-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]quinoline-2-carboxamide is CN1CC[C@@H](NC(=O)c2ccc3ccccc3n2)C1=O.
What is the InChIKey of N-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]quinoline-2-carboxamide?
The InChIKey is LSOQCIPQOUTCBB-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H15N3O2/c1-18-9-8-13(15(18)20)17-14(19)12-7-6-10-4-2-3-5-11(10)16-12/h2-7,13H,8-9H2,1H3,(H,17,19)/t13-/m1/s1.
What are the key properties of N-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]quinoline-2-carboxamide?
N-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]quinoline-2-carboxamide has a molecular weight of 269.30 g/mol, XLogP of 1.20, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]quinoline-2-carboxamide is sourced from PubChem (CID 96506885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).