3-amino-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide

C8H7N3OS2 — CID 61090146

IUPAC3-amino-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide
SMILESNc1ccsc1C(=O)Nc1nccs1
InChIInChI=1S/C8H7N3OS2/c9-5-1-3-13-6(5)7(12)11-8-10-2-4-14-8/h1-4H,9H2,(H,10,11,12)
InChIKeyKHQRTBDFEJDOLQ-UHFFFAOYSA-N
MW225.30 g/mol
LogP2.04
Rot. Bonds2

About 3-amino-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide

3-amino-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide (PubChem CID 61090146) has the molecular formula C8H7N3OS2 and a molecular weight of 225.30 g/mol. Its IUPAC name is 3-amino-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide
PubChem CID61090146
Molecular FormulaC8H7N3OS2
Molecular Weight225.30 g/mol
Exact Mass225.00
IUPAC Name3-amino-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide
SMILESNc1ccsc1C(=O)Nc1nccs1
InChIInChI=1S/C8H7N3OS2/c9-5-1-3-13-6(5)7(12)11-8-10-2-4-14-8/h1-4H,9H2,(H,10,11,12)
InChIKeyKHQRTBDFEJDOLQ-UHFFFAOYSA-N
XLogP2.04
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.30
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-N-(thiatriazol-5-yl)thiophene-2-carboxamide
CID 114911590
3-amino-N-(3-chloro-2-pyridinyl)thiophene-2-carboxamide
CID 103093844
3-amino-4-methyl-N-(1,3-thiazol-2-yl)benzamide
CID 16771043
4-amino-N-(1,3-thiazol-2-yl)-1H-pyrazole-5-carboxamide
CID 63107015
N-(1,3-thiazol-2-yl)benzamide;hydrochloride
CID 141066064
3-amino-2-(methylamino)-N-(1,3-thiazol-2-yl)benzamide
CID 143922390
1,3-thiazol-2-ylurea;hydrochloride
CID 118455578
3-amino-N-(5-chloro-2-pyridinyl)thiophene-2-carboxamide
CID 61094139
3-amino-N-(5-methyl-2-pyridinyl)thiophene-2-carboxamide
CID 61093920
5-amino-N-(1,3-thiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-8-carboxamide
CID 86046983
3-amino-N-(4-chlorophenyl)thiophene-2-carboxamide
CID 61092440
2-methylsulfanyl-N-(1,3-thiazol-2-yl)pyridine-4-carboxamide
CID 60564390

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide?
The IUPAC name of 3-amino-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide (CID 61090146) is 3-amino-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide.
What is the SMILES notation for 3-amino-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide?
The canonical SMILES for 3-amino-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide is Nc1ccsc1C(=O)Nc1nccs1.
What is the InChIKey of 3-amino-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide?
The InChIKey is KHQRTBDFEJDOLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3OS2/c9-5-1-3-13-6(5)7(12)11-8-10-2-4-14-8/h1-4H,9H2,(H,10,11,12).
What are the key properties of 3-amino-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide?
3-amino-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide has a molecular weight of 225.30 g/mol, XLogP of 2.04, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide is sourced from PubChem (CID 61090146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).