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

C14H10N2OS2 — CID 17417127

IUPACN-(4-phenyl-1,3-thiazol-2-yl)thiophene-3-carboxamide
SMILESO=C(Nc1nc(-c2ccccc2)cs1)c1ccsc1
InChIInChI=1S/C14H10N2OS2/c17-13(11-6-7-18-8-11)16-14-15-12(9-19-14)10-4-2-1-3-5-10/h1-9H,(H,15,16,17)
InChIKeyRPNIVCTXVFKQLH-UHFFFAOYSA-N
MW286.38 g/mol
LogP4.12
Rot. Bonds3

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

N-(4-phenyl-1,3-thiazol-2-yl)thiophene-3-carboxamide (PubChem CID 17417127) has the molecular formula C14H10N2OS2 and a molecular weight of 286.38 g/mol. Its IUPAC name is N-(4-phenyl-1,3-thiazol-2-yl)thiophene-3-carboxamide.

Molecular Properties

Compound NameN-(4-phenyl-1,3-thiazol-2-yl)thiophene-3-carboxamide
PubChem CID17417127
Molecular FormulaC14H10N2OS2
Molecular Weight286.38 g/mol
Exact Mass286.02
IUPAC NameN-(4-phenyl-1,3-thiazol-2-yl)thiophene-3-carboxamide
SMILESO=C(Nc1nc(-c2ccccc2)cs1)c1ccsc1
InChIInChI=1S/C14H10N2OS2/c17-13(11-6-7-18-8-11)16-14-15-12(9-19-14)10-4-2-1-3-5-10/h1-9H,(H,15,16,17)
InChIKeyRPNIVCTXVFKQLH-UHFFFAOYSA-N
XLogP4.12
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]thiophene-3-carboxamide
CID 17417571
4-bromo-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
CID 988802
N-[4-(2-benzamido-1,3-thiazol-4-yl)-1,3-thiazol-2-yl]benzamide
CID 4294892
1,3-bis(4-phenyl-1,3-thiazol-2-yl)urea
CID 13089293
4-chloro-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]benzamide
CID 2332435
4-acetamido-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]benzamide
CID 2463728
N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-4-phenylbenzamide
CID 3308072
2-methyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
CID 576996
N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-4-phenylbenzamide
CID 3120660
N-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]benzamide
CID 40596964
9-oxo-N-(4-phenyl-1,3-thiazol-2-yl)fluorene-2-carboxamide
CID 16613201
3-cyano-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]benzamide
CID 7948158

Frequently Asked Questions

What is the IUPAC name of N-(4-phenyl-1,3-thiazol-2-yl)thiophene-3-carboxamide?
The IUPAC name of N-(4-phenyl-1,3-thiazol-2-yl)thiophene-3-carboxamide (CID 17417127) is N-(4-phenyl-1,3-thiazol-2-yl)thiophene-3-carboxamide.
What is the SMILES notation for N-(4-phenyl-1,3-thiazol-2-yl)thiophene-3-carboxamide?
The canonical SMILES for N-(4-phenyl-1,3-thiazol-2-yl)thiophene-3-carboxamide is O=C(Nc1nc(-c2ccccc2)cs1)c1ccsc1.
What is the InChIKey of N-(4-phenyl-1,3-thiazol-2-yl)thiophene-3-carboxamide?
The InChIKey is RPNIVCTXVFKQLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2OS2/c17-13(11-6-7-18-8-11)16-14-15-12(9-19-14)10-4-2-1-3-5-10/h1-9H,(H,15,16,17).
What are the key properties of N-(4-phenyl-1,3-thiazol-2-yl)thiophene-3-carboxamide?
N-(4-phenyl-1,3-thiazol-2-yl)thiophene-3-carboxamide has a molecular weight of 286.38 g/mol, XLogP of 4.12, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-phenyl-1,3-thiazol-2-yl)thiophene-3-carboxamide is sourced from PubChem (CID 17417127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).