3-amino-N-(1-thiophen-3-ylpropan-2-yl)thiophene-2-carboxamide

C12H14N2OS2 — CID 54952813

IUPAC3-amino-N-(1-thiophen-3-ylpropan-2-yl)thiophene-2-carboxamide
SMILESCC(Cc1ccsc1)NC(=O)c1sccc1N
InChIInChI=1S/C12H14N2OS2/c1-8(6-9-2-4-16-7-9)14-12(15)11-10(13)3-5-17-11/h2-5,7-8H,6,13H2,1H3,(H,14,15)
InChIKeyCZTCYCATTFIUBK-UHFFFAOYSA-N
MW266.39 g/mol
LogP2.75
Rot. Bonds4

About 3-amino-N-(1-thiophen-3-ylpropan-2-yl)thiophene-2-carboxamide

3-amino-N-(1-thiophen-3-ylpropan-2-yl)thiophene-2-carboxamide (PubChem CID 54952813) has the molecular formula C12H14N2OS2 and a molecular weight of 266.39 g/mol. Its IUPAC name is 3-amino-N-(1-thiophen-3-ylpropan-2-yl)thiophene-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-(1-thiophen-3-ylpropan-2-yl)thiophene-2-carboxamide
PubChem CID54952813
Molecular FormulaC12H14N2OS2
Molecular Weight266.39 g/mol
Exact Mass266.05
IUPAC Name3-amino-N-(1-thiophen-3-ylpropan-2-yl)thiophene-2-carboxamide
SMILESCC(Cc1ccsc1)NC(=O)c1sccc1N
InChIInChI=1S/C12H14N2OS2/c1-8(6-9-2-4-16-7-9)14-12(15)11-10(13)3-5-17-11/h2-5,7-8H,6,13H2,1H3,(H,14,15)
InChIKeyCZTCYCATTFIUBK-UHFFFAOYSA-N
XLogP2.75
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-(4-hydroxybutan-2-yl)thiophene-2-carboxamide
CID 83176272
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CID 61471843
3-amino-N-(1-thiophen-3-ylethyl)thiophene-2-carboxamide
CID 62840601
3-amino-N-[1-(2,6-difluorophenyl)propan-2-yl]thiophene-2-carboxamide
CID 61103749
4-amino-N-(1-thiophen-3-ylpropan-2-yl)pyridine-2-carboxamide
CID 62186482
2-amino-5-methyl-N-(1-thiophen-3-ylpropan-2-yl)benzamide
CID 62509065
(2S)-2-amino-3-methyl-N-(1-thiophen-3-ylpropan-2-yl)butanamide
CID 61474644
2-(1-thiophen-3-ylpropan-2-ylcarbamoyl)benzoic acid
CID 61475052
3-amino-4-ethoxy-N-(1-thiophen-3-ylpropan-2-yl)benzamide
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CID 61473973
1,3-dimethyl-2,6-dioxo-N-(1-thiophen-3-ylpropan-2-yl)pyrimidine-4-carboxamide
CID 131894123
4-methyl-2-pyrimidin-2-yl-N-[(2R)-1-thiophen-3-ylpropan-2-yl]-1,3-thiazole-5-carboxamide
CID 97313604

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(1-thiophen-3-ylpropan-2-yl)thiophene-2-carboxamide?
The IUPAC name of 3-amino-N-(1-thiophen-3-ylpropan-2-yl)thiophene-2-carboxamide (CID 54952813) is 3-amino-N-(1-thiophen-3-ylpropan-2-yl)thiophene-2-carboxamide.
What is the SMILES notation for 3-amino-N-(1-thiophen-3-ylpropan-2-yl)thiophene-2-carboxamide?
The canonical SMILES for 3-amino-N-(1-thiophen-3-ylpropan-2-yl)thiophene-2-carboxamide is CC(Cc1ccsc1)NC(=O)c1sccc1N.
What is the InChIKey of 3-amino-N-(1-thiophen-3-ylpropan-2-yl)thiophene-2-carboxamide?
The InChIKey is CZTCYCATTFIUBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2OS2/c1-8(6-9-2-4-16-7-9)14-12(15)11-10(13)3-5-17-11/h2-5,7-8H,6,13H2,1H3,(H,14,15).
What are the key properties of 3-amino-N-(1-thiophen-3-ylpropan-2-yl)thiophene-2-carboxamide?
3-amino-N-(1-thiophen-3-ylpropan-2-yl)thiophene-2-carboxamide has a molecular weight of 266.39 g/mol, XLogP of 2.75, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(1-thiophen-3-ylpropan-2-yl)thiophene-2-carboxamide is sourced from PubChem (CID 54952813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).