3-methoxy-5-methyl-N-pyrrolidin-3-ylthiophene-2-carboxamide

C11H16N2O2S — CID 119453724

IUPAC3-methoxy-5-methyl-N-pyrrolidin-3-ylthiophene-2-carboxamide
SMILESCOc1cc(C)sc1C(=O)NC1CCNC1
InChIInChI=1S/C11H16N2O2S/c1-7-5-9(15-2)10(16-7)11(14)13-8-3-4-12-6-8/h5,8,12H,3-4,6H2,1-2H3,(H,13,14)
InChIKeyJSOUJMGTFMUKEK-UHFFFAOYSA-N
MW240.33 g/mol
LogP1.16
Rot. Bonds3

About 3-methoxy-5-methyl-N-pyrrolidin-3-ylthiophene-2-carboxamide

3-methoxy-5-methyl-N-pyrrolidin-3-ylthiophene-2-carboxamide (PubChem CID 119453724) has the molecular formula C11H16N2O2S and a molecular weight of 240.33 g/mol. Its IUPAC name is 3-methoxy-5-methyl-N-pyrrolidin-3-ylthiophene-2-carboxamide.

Molecular Properties

Compound Name3-methoxy-5-methyl-N-pyrrolidin-3-ylthiophene-2-carboxamide
PubChem CID119453724
Molecular FormulaC11H16N2O2S
Molecular Weight240.33 g/mol
Exact Mass240.09
IUPAC Name3-methoxy-5-methyl-N-pyrrolidin-3-ylthiophene-2-carboxamide
SMILESCOc1cc(C)sc1C(=O)NC1CCNC1
InChIInChI=1S/C11H16N2O2S/c1-7-5-9(15-2)10(16-7)11(14)13-8-3-4-12-6-8/h5,8,12H,3-4,6H2,1-2H3,(H,13,14)
InChIKeyJSOUJMGTFMUKEK-UHFFFAOYSA-N
XLogP1.16
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.33
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-methoxy-5-methyl-N-piperidin-3-ylthiophene-2-carboxamide;hydrochloride
CID 119428596
3-methoxy-5-methyl-N-(2-pyrrolidin-3-ylethyl)thiophene-2-carboxamide
CID 119537568
3-methoxy-5-phenyl-N-pyrrolidin-3-ylthiophene-2-carboxamide;hydrochloride
CID 119452328
3-methoxy-5-phenyl-N-piperidin-3-ylthiophene-2-carboxamide;hydrochloride
CID 119427157
2-(3,4-dimethoxyphenyl)-4-methyl-N-pyrrolidin-3-yl-1,3-thiazole-5-carboxamide
CID 119452667
3,5-dimethoxy-4-methyl-N-piperidin-3-ylbenzamide;hydrochloride
CID 119429058
3-(difluoromethoxy)-5-methyl-N-(3-methylpiperidin-4-yl)thiophene-2-carboxamide
CID 120555716
N-[(3R)-1,1-dioxo-2,3-dihydrothiophen-3-yl]-3-methoxy-5-methylthiophene-2-carboxamide
CID 99938378
3-ethoxy-5-phenyl-N-pyrrolidin-3-ylthiophene-2-carboxamide
CID 119449775
2,4,5-trimethoxy-N-piperidin-3-ylbenzamide;hydrochloride
CID 119426612
N-[(1S,5S,6R,7S)-7-acetamido-2-oxabicyclo[3.2.0]heptan-6-yl]-3-methoxy-5-methylthiophene-2-carboxamide
CID 133268611
4-methyl-N-[(3R)-pyrrolidin-3-yl]thiadiazole-5-carboxamide
CID 79685772

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-5-methyl-N-pyrrolidin-3-ylthiophene-2-carboxamide?
The IUPAC name of 3-methoxy-5-methyl-N-pyrrolidin-3-ylthiophene-2-carboxamide (CID 119453724) is 3-methoxy-5-methyl-N-pyrrolidin-3-ylthiophene-2-carboxamide.
What is the SMILES notation for 3-methoxy-5-methyl-N-pyrrolidin-3-ylthiophene-2-carboxamide?
The canonical SMILES for 3-methoxy-5-methyl-N-pyrrolidin-3-ylthiophene-2-carboxamide is COc1cc(C)sc1C(=O)NC1CCNC1.
What is the InChIKey of 3-methoxy-5-methyl-N-pyrrolidin-3-ylthiophene-2-carboxamide?
The InChIKey is JSOUJMGTFMUKEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2S/c1-7-5-9(15-2)10(16-7)11(14)13-8-3-4-12-6-8/h5,8,12H,3-4,6H2,1-2H3,(H,13,14).
What are the key properties of 3-methoxy-5-methyl-N-pyrrolidin-3-ylthiophene-2-carboxamide?
3-methoxy-5-methyl-N-pyrrolidin-3-ylthiophene-2-carboxamide has a molecular weight of 240.33 g/mol, XLogP of 1.16, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-5-methyl-N-pyrrolidin-3-ylthiophene-2-carboxamide is sourced from PubChem (CID 119453724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).