N-[4-(3-cyclopropyl-2-oxopyrrolidin-1-yl)-2-pyridinyl]-2-thiophen-2-ylacetamide

C18H19N3O2S — CID 139333108

IUPACN-[4-(3-cyclopropyl-2-oxopyrrolidin-1-yl)-2-pyridinyl]-2-thiophen-2-ylacetamide
SMILESO=C(Cc1cccs1)Nc1cc(N2CCC(C3CC3)C2=O)ccn1
InChIInChI=1S/C18H19N3O2S/c22-17(11-14-2-1-9-24-14)20-16-10-13(5-7-19-16)21-8-6-15(18(21)23)12-3-4-12/h1-2,5,7,9-10,12,15H,3-4,6,8,11H2,(H,19,20,22)
InChIKeyYGRAKIFACOONMK-UHFFFAOYSA-N
MW341.44 g/mol
LogP3.09
Rot. Bonds5

About N-[4-(3-cyclopropyl-2-oxopyrrolidin-1-yl)-2-pyridinyl]-2-thiophen-2-ylacetamide

N-[4-(3-cyclopropyl-2-oxopyrrolidin-1-yl)-2-pyridinyl]-2-thiophen-2-ylacetamide (PubChem CID 139333108) has the molecular formula C18H19N3O2S and a molecular weight of 341.44 g/mol. Its IUPAC name is N-[4-(3-cyclopropyl-2-oxopyrrolidin-1-yl)-2-pyridinyl]-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-[4-(3-cyclopropyl-2-oxopyrrolidin-1-yl)-2-pyridinyl]-2-thiophen-2-ylacetamide
PubChem CID139333108
Molecular FormulaC18H19N3O2S
Molecular Weight341.44 g/mol
Exact Mass341.12
IUPAC NameN-[4-(3-cyclopropyl-2-oxopyrrolidin-1-yl)-2-pyridinyl]-2-thiophen-2-ylacetamide
SMILESO=C(Cc1cccs1)Nc1cc(N2CCC(C3CC3)C2=O)ccn1
InChIInChI=1S/C18H19N3O2S/c22-17(11-14-2-1-9-24-14)20-16-10-13(5-7-19-16)21-8-6-15(18(21)23)12-3-4-12/h1-2,5,7,9-10,12,15H,3-4,6,8,11H2,(H,19,20,22)
InChIKeyYGRAKIFACOONMK-UHFFFAOYSA-N
XLogP3.09
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.44
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-methoxy-2-pyridinyl)-2-thiophen-2-ylacetamide
CID 75435246
N-(3-hydroxy-2-pyridinyl)-2-thiophen-2-ylacetamide
CID 110462769
N-[3-(2-oxoimidazolidin-1-yl)phenyl]-2-thiophen-2-ylacetamide
CID 47036521
N-[4-(4-methylpiperidin-1-yl)phenyl]-2-thiophen-2-ylacetamide
CID 9302925
2-thiophen-2-yl-N-([1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetamide
CID 47076133
N-[3-(aminomethyl)-2-pyridinyl]-2-thiophen-2-ylacetamide
CID 82344031
5-(4-pyrimidin-2-yl-1,4-diazepan-1-yl)-2-[(2-thiophen-2-ylacetyl)amino]benzoic acid
CID 50782780
N-cyclooctyl-2-thiophen-2-ylacetamide
CID 17256729
N-(1-methylimidazol-2-yl)-2-thiophen-2-ylacetamide
CID 110472554
N-(1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidin-5-yl)-2-thiophen-2-ylacetamide
CID 16841396
N-[(3S)-1-cyclopropyl-5-oxopyrrolidin-3-yl]-2-thiophen-2-ylacetamide
CID 95968730
N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)-2-thiophen-2-ylacetamide
CID 17341539

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-cyclopropyl-2-oxopyrrolidin-1-yl)-2-pyridinyl]-2-thiophen-2-ylacetamide?
The IUPAC name of N-[4-(3-cyclopropyl-2-oxopyrrolidin-1-yl)-2-pyridinyl]-2-thiophen-2-ylacetamide (CID 139333108) is N-[4-(3-cyclopropyl-2-oxopyrrolidin-1-yl)-2-pyridinyl]-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-[4-(3-cyclopropyl-2-oxopyrrolidin-1-yl)-2-pyridinyl]-2-thiophen-2-ylacetamide?
The canonical SMILES for N-[4-(3-cyclopropyl-2-oxopyrrolidin-1-yl)-2-pyridinyl]-2-thiophen-2-ylacetamide is O=C(Cc1cccs1)Nc1cc(N2CCC(C3CC3)C2=O)ccn1.
What is the InChIKey of N-[4-(3-cyclopropyl-2-oxopyrrolidin-1-yl)-2-pyridinyl]-2-thiophen-2-ylacetamide?
The InChIKey is YGRAKIFACOONMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O2S/c22-17(11-14-2-1-9-24-14)20-16-10-13(5-7-19-16)21-8-6-15(18(21)23)12-3-4-12/h1-2,5,7,9-10,12,15H,3-4,6,8,11H2,(H,19,20,22).
What are the key properties of N-[4-(3-cyclopropyl-2-oxopyrrolidin-1-yl)-2-pyridinyl]-2-thiophen-2-ylacetamide?
N-[4-(3-cyclopropyl-2-oxopyrrolidin-1-yl)-2-pyridinyl]-2-thiophen-2-ylacetamide has a molecular weight of 341.44 g/mol, XLogP of 3.09, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-cyclopropyl-2-oxopyrrolidin-1-yl)-2-pyridinyl]-2-thiophen-2-ylacetamide is sourced from PubChem (CID 139333108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).