3-quinolin-2-yloxy-N-thiophen-2-ylpyrrolidine-1-carboxamide

C18H17N3O2S — CID 91815876

IUPAC3-quinolin-2-yloxy-N-thiophen-2-ylpyrrolidine-1-carboxamide
SMILESO=C(Nc1cccs1)N1CCC(Oc2ccc3ccccc3n2)C1
InChIInChI=1S/C18H17N3O2S/c22-18(20-17-6-3-11-24-17)21-10-9-14(12-21)23-16-8-7-13-4-1-2-5-15(13)19-16/h1-8,11,14H,9-10,12H2,(H,20,22)
InChIKeyKWHJEFZUWZKAMP-UHFFFAOYSA-N
MW339.42 g/mol
LogP3.98
Rot. Bonds3

About 3-quinolin-2-yloxy-N-thiophen-2-ylpyrrolidine-1-carboxamide

3-quinolin-2-yloxy-N-thiophen-2-ylpyrrolidine-1-carboxamide (PubChem CID 91815876) has the molecular formula C18H17N3O2S and a molecular weight of 339.42 g/mol. Its IUPAC name is 3-quinolin-2-yloxy-N-thiophen-2-ylpyrrolidine-1-carboxamide.

Molecular Properties

Compound Name3-quinolin-2-yloxy-N-thiophen-2-ylpyrrolidine-1-carboxamide
PubChem CID91815876
Molecular FormulaC18H17N3O2S
Molecular Weight339.42 g/mol
Exact Mass339.10
IUPAC Name3-quinolin-2-yloxy-N-thiophen-2-ylpyrrolidine-1-carboxamide
SMILESO=C(Nc1cccs1)N1CCC(Oc2ccc3ccccc3n2)C1
InChIInChI=1S/C18H17N3O2S/c22-18(20-17-6-3-11-24-17)21-10-9-14(12-21)23-16-8-7-13-4-1-2-5-15(13)19-16/h1-8,11,14H,9-10,12H2,(H,20,22)
InChIKeyKWHJEFZUWZKAMP-UHFFFAOYSA-N
XLogP3.98
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.42
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-quinolin-2-yloxy-N-thiophen-2-ylpyrrolidine-1-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

(3S)-3-quinolin-2-yloxy-N-thiophen-2-ylpyrrolidine-1-carboxamide
CID 100740167
(3R)-3-(6-methoxypyridazin-3-yl)oxy-N-thiophen-2-ylpyrrolidine-1-carboxamide
CID 100633412
(3S)-3-pyrazin-2-yloxy-N-thiophen-2-ylpyrrolidine-1-carboxamide
CID 100754062
(2-chlorophenyl)-(3-quinolin-2-yloxypyrrolidin-1-yl)methanone
CID 91815832
pyridin-2-yl-(3-quinolin-2-yloxypyrrolidin-1-yl)methanone
CID 91815849
4-pyrimidin-2-yloxy-N-thiophen-2-ylpiperidine-1-carboxamide
CID 90558841
N-(4-methylphenyl)-3-quinolin-2-yloxyazetidine-1-carboxamide
CID 122250544
3-[(5-chloro-2-pyridinyl)oxy]-N-thiophen-2-ylazetidine-1-carboxamide
CID 122248492
N-thiophen-2-yl-4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]piperidine-1-carboxamide
CID 71798781
4-(3-quinolin-2-yloxypyrrolidine-1-carbonyl)benzonitrile
CID 91815852
(2-methoxy-3-pyridinyl)-[(3R)-3-quinolin-2-yloxypyrrolidin-1-yl]methanone
CID 124727992
2-(4-fluorophenyl)sulfanyl-1-[(3R)-3-quinolin-2-yloxypyrrolidin-1-yl]ethanone
CID 100739813

Frequently Asked Questions

What is the IUPAC name of 3-quinolin-2-yloxy-N-thiophen-2-ylpyrrolidine-1-carboxamide?
The IUPAC name of 3-quinolin-2-yloxy-N-thiophen-2-ylpyrrolidine-1-carboxamide (CID 91815876) is 3-quinolin-2-yloxy-N-thiophen-2-ylpyrrolidine-1-carboxamide.
What is the SMILES notation for 3-quinolin-2-yloxy-N-thiophen-2-ylpyrrolidine-1-carboxamide?
The canonical SMILES for 3-quinolin-2-yloxy-N-thiophen-2-ylpyrrolidine-1-carboxamide is O=C(Nc1cccs1)N1CCC(Oc2ccc3ccccc3n2)C1.
What is the InChIKey of 3-quinolin-2-yloxy-N-thiophen-2-ylpyrrolidine-1-carboxamide?
The InChIKey is KWHJEFZUWZKAMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O2S/c22-18(20-17-6-3-11-24-17)21-10-9-14(12-21)23-16-8-7-13-4-1-2-5-15(13)19-16/h1-8,11,14H,9-10,12H2,(H,20,22).
What are the key properties of 3-quinolin-2-yloxy-N-thiophen-2-ylpyrrolidine-1-carboxamide?
3-quinolin-2-yloxy-N-thiophen-2-ylpyrrolidine-1-carboxamide has a molecular weight of 339.42 g/mol, XLogP of 3.98, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-quinolin-2-yloxy-N-thiophen-2-ylpyrrolidine-1-carboxamide is sourced from PubChem (CID 91815876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).