N-(5-amino-4-phenyl-1,3-thiazol-2-yl)thiophene-2-carboxamide

C14H11N3OS2 — CID 82342247

IUPACN-(5-amino-4-phenyl-1,3-thiazol-2-yl)thiophene-2-carboxamide
SMILESNc1sc(NC(=O)c2cccs2)nc1-c1ccccc1
InChIInChI=1S/C14H11N3OS2/c15-12-11(9-5-2-1-3-6-9)16-14(20-12)17-13(18)10-7-4-8-19-10/h1-8H,15H2,(H,16,17,18)
InChIKeyWVTTWWMFKBKIPT-UHFFFAOYSA-N
MW301.40 g/mol
LogP3.71
Rot. Bonds3

About N-(5-amino-4-phenyl-1,3-thiazol-2-yl)thiophene-2-carboxamide

N-(5-amino-4-phenyl-1,3-thiazol-2-yl)thiophene-2-carboxamide (PubChem CID 82342247) has the molecular formula C14H11N3OS2 and a molecular weight of 301.40 g/mol. Its IUPAC name is N-(5-amino-4-phenyl-1,3-thiazol-2-yl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(5-amino-4-phenyl-1,3-thiazol-2-yl)thiophene-2-carboxamide
PubChem CID82342247
Molecular FormulaC14H11N3OS2
Molecular Weight301.40 g/mol
Exact Mass301.03
IUPAC NameN-(5-amino-4-phenyl-1,3-thiazol-2-yl)thiophene-2-carboxamide
SMILESNc1sc(NC(=O)c2cccs2)nc1-c1ccccc1
InChIInChI=1S/C14H11N3OS2/c15-12-11(9-5-2-1-3-6-9)16-14(20-12)17-13(18)10-7-4-8-19-10/h1-8H,15H2,(H,16,17,18)
InChIKeyWVTTWWMFKBKIPT-UHFFFAOYSA-N
XLogP3.71
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.40
LogP ≤ 53.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[5-(4-methoxyphenyl)-4-phenyl-1,3-thiazol-2-yl]thiophene-2-carboxamide
CID 2281805
N-(5-amino-4-phenyl-1,3-thiazol-2-yl)-2,2-dimethylpropanamide
CID 82342240
N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]thiophene-2-carboxamide
CID 3151931
N-(3-phenyl-1,2,4-thiadiazol-5-yl)thiophene-2-carboxamide
CID 972595
ethyl N-(5-amino-4-phenyl-1,3-thiazol-2-yl)carbamate
CID 58911903
N-(2-methylsulfanyl-4-phenyl-1,3-thiazol-5-yl)thiophene-2-carboxamide
CID 25282899
N-[2-[(2E)-2-[(4-hydroxyphenyl)methylidene]hydrazinyl]-4-phenyl-1,3-thiazol-5-yl]thiophene-2-carboxamide
CID 135555294
N-(6-phenyl-2-pyridinyl)thiophene-2-carboxamide
CID 110482191
N-[4-(4-methoxyphenyl)-5-propyl-1,3-thiazol-2-yl]thiophene-2-carboxamide
CID 1348974
N-(6-phenyl-2-piperidin-1-ylimidazo[2,1-b][1,3,4]thiadiazol-5-yl)thiophene-2-carboxamide
CID 53206328
2-(thiophene-2-carbonylamino)-1,3-thiazole-4-carboxamide
CID 16915451
N-[4-(2-phenylquinazolin-4-yl)phenyl]thiophene-2-carboxamide
CID 126189754

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-4-phenyl-1,3-thiazol-2-yl)thiophene-2-carboxamide?
The IUPAC name of N-(5-amino-4-phenyl-1,3-thiazol-2-yl)thiophene-2-carboxamide (CID 82342247) is N-(5-amino-4-phenyl-1,3-thiazol-2-yl)thiophene-2-carboxamide.
What is the SMILES notation for N-(5-amino-4-phenyl-1,3-thiazol-2-yl)thiophene-2-carboxamide?
The canonical SMILES for N-(5-amino-4-phenyl-1,3-thiazol-2-yl)thiophene-2-carboxamide is Nc1sc(NC(=O)c2cccs2)nc1-c1ccccc1.
What is the InChIKey of N-(5-amino-4-phenyl-1,3-thiazol-2-yl)thiophene-2-carboxamide?
The InChIKey is WVTTWWMFKBKIPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3OS2/c15-12-11(9-5-2-1-3-6-9)16-14(20-12)17-13(18)10-7-4-8-19-10/h1-8H,15H2,(H,16,17,18).
What are the key properties of N-(5-amino-4-phenyl-1,3-thiazol-2-yl)thiophene-2-carboxamide?
N-(5-amino-4-phenyl-1,3-thiazol-2-yl)thiophene-2-carboxamide has a molecular weight of 301.40 g/mol, XLogP of 3.71, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-4-phenyl-1,3-thiazol-2-yl)thiophene-2-carboxamide is sourced from PubChem (CID 82342247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).