5-acetyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]thiophene-2-carboxamide

C15H20N2O3S — CID 91789169

IUPAC5-acetyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]thiophene-2-carboxamide
SMILESCC(=O)c1ccc(C(=O)N[C@H]2COC[C@@H]2N2CCCC2)s1
InChIInChI=1S/C15H20N2O3S/c1-10(18)13-4-5-14(21-13)15(19)16-11-8-20-9-12(11)17-6-2-3-7-17/h4-5,11-12H,2-3,6-9H2,1H3,(H,16,19)/t11-,12-/m0/s1
InChIKeyCHDCYFZPJQSPCJ-RYUDHWBXSA-N
MW308.40 g/mol
LogP1.54
Rot. Bonds4

About 5-acetyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]thiophene-2-carboxamide

5-acetyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]thiophene-2-carboxamide (PubChem CID 91789169) has the molecular formula C15H20N2O3S and a molecular weight of 308.40 g/mol. Its IUPAC name is 5-acetyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]thiophene-2-carboxamide.

Molecular Properties

Compound Name5-acetyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]thiophene-2-carboxamide
PubChem CID91789169
Molecular FormulaC15H20N2O3S
Molecular Weight308.40 g/mol
Exact Mass308.12
IUPAC Name5-acetyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]thiophene-2-carboxamide
SMILESCC(=O)c1ccc(C(=O)N[C@H]2COC[C@@H]2N2CCCC2)s1
InChIInChI=1S/C15H20N2O3S/c1-10(18)13-4-5-14(21-13)15(19)16-11-8-20-9-12(11)17-6-2-3-7-17/h4-5,11-12H,2-3,6-9H2,1H3,(H,16,19)/t11-,12-/m0/s1
InChIKeyCHDCYFZPJQSPCJ-RYUDHWBXSA-N
XLogP1.54
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.40
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-acetyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]thiophene-2-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

5-acetyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]thiophene-2-carboxamide
CID 118790643
5-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]-1,2-oxazole-3-carboxamide
CID 122556576
2,4-dimethyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]-1,3-oxazole-5-carboxamide
CID 122565102
2-cyano-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]benzamide
CID 118781498
6-oxo-N-[(3S,4S)-4-piperidin-1-yloxolan-3-yl]-1H-pyridine-3-carboxamide
CID 133260544
5-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]-1,3-oxazole-4-carboxamide
CID 122559298
1-methyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]indole-2-carboxamide
CID 91841039
N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]-2-thiophen-2-ylacetamide
CID 122560557
formic acid;1-methyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]imidazole-2-carboxamide
CID 154911071
5-acetyl-N-cyclopropylthiophene-2-carboxamide
CID 9080124
2-(ethylamino)-4-methyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]-1,3-thiazole-5-carboxamide
CID 118794593
2-methoxy-N-[(3S,4S)-4-piperidin-1-yloxolan-3-yl]pyridine-3-carboxamide
CID 133267819

Frequently Asked Questions

What is the IUPAC name of 5-acetyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]thiophene-2-carboxamide?
The IUPAC name of 5-acetyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]thiophene-2-carboxamide (CID 91789169) is 5-acetyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]thiophene-2-carboxamide.
What is the SMILES notation for 5-acetyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]thiophene-2-carboxamide?
The canonical SMILES for 5-acetyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]thiophene-2-carboxamide is CC(=O)c1ccc(C(=O)N[C@H]2COC[C@@H]2N2CCCC2)s1.
What is the InChIKey of 5-acetyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]thiophene-2-carboxamide?
The InChIKey is CHDCYFZPJQSPCJ-RYUDHWBXSA-N. The full InChI is InChI=1S/C15H20N2O3S/c1-10(18)13-4-5-14(21-13)15(19)16-11-8-20-9-12(11)17-6-2-3-7-17/h4-5,11-12H,2-3,6-9H2,1H3,(H,16,19)/t11-,12-/m0/s1.
What are the key properties of 5-acetyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]thiophene-2-carboxamide?
5-acetyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]thiophene-2-carboxamide has a molecular weight of 308.40 g/mol, XLogP of 1.54, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-acetyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]thiophene-2-carboxamide is sourced from PubChem (CID 91789169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).