N-(4-methyl-1,3-thiazol-2-yl)-5-propylthiophene-3-carboxamide

C12H14N2OS2 — CID 25237549

IUPACN-(4-methyl-1,3-thiazol-2-yl)-5-propylthiophene-3-carboxamide
SMILESCCCc1cc(C(=O)Nc2nc(C)cs2)cs1
InChIInChI=1S/C12H14N2OS2/c1-3-4-10-5-9(7-16-10)11(15)14-12-13-8(2)6-17-12/h5-7H,3-4H2,1-2H3,(H,13,14,15)
InChIKeyOEZASGCTUFKUTK-UHFFFAOYSA-N
MW266.39 g/mol
LogP3.72
Rot. Bonds4

About N-(4-methyl-1,3-thiazol-2-yl)-5-propylthiophene-3-carboxamide

N-(4-methyl-1,3-thiazol-2-yl)-5-propylthiophene-3-carboxamide (PubChem CID 25237549) has the molecular formula C12H14N2OS2 and a molecular weight of 266.39 g/mol. Its IUPAC name is N-(4-methyl-1,3-thiazol-2-yl)-5-propylthiophene-3-carboxamide.

Molecular Properties

Compound NameN-(4-methyl-1,3-thiazol-2-yl)-5-propylthiophene-3-carboxamide
PubChem CID25237549
Molecular FormulaC12H14N2OS2
Molecular Weight266.39 g/mol
Exact Mass266.05
IUPAC NameN-(4-methyl-1,3-thiazol-2-yl)-5-propylthiophene-3-carboxamide
SMILESCCCc1cc(C(=O)Nc2nc(C)cs2)cs1
InChIInChI=1S/C12H14N2OS2/c1-3-4-10-5-9(7-16-10)11(15)14-12-13-8(2)6-17-12/h5-7H,3-4H2,1-2H3,(H,13,14,15)
InChIKeyOEZASGCTUFKUTK-UHFFFAOYSA-N
XLogP3.72
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-ethyl-N-(4-methyl-1,3-thiazol-2-yl)thiophene-3-carboxamide
CID 25237547
3,5-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 1246749
4-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 885062
N-(1,2-oxazol-3-yl)-5-propylthiophene-3-carboxamide
CID 17217748
4-(butanoylamino)-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 7326262
3-[4-[(4-methyl-1,3-thiazol-2-yl)carbamoyl]thiophen-2-yl]prop-2-enoic acid
CID 79684734
4-N-(4-methyl-1,3-thiazol-2-yl)benzene-1,4-dicarboxamide
CID 47106736
4-bromo-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 683754
4-(methylamino)-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 62173171
4-methyl-N-(4-methyl-1,3-thiazol-2-yl)-1,3-thiazole-2-carboxamide
CID 110696245
2-N,6-N-bis(4-methyl-1,3-thiazol-2-yl)pyridine-2,6-dicarboxamide
CID 19684989
N-cyclopropyl-5-propylthiophene-3-carboxamide
CID 1244120

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-1,3-thiazol-2-yl)-5-propylthiophene-3-carboxamide?
The IUPAC name of N-(4-methyl-1,3-thiazol-2-yl)-5-propylthiophene-3-carboxamide (CID 25237549) is N-(4-methyl-1,3-thiazol-2-yl)-5-propylthiophene-3-carboxamide.
What is the SMILES notation for N-(4-methyl-1,3-thiazol-2-yl)-5-propylthiophene-3-carboxamide?
The canonical SMILES for N-(4-methyl-1,3-thiazol-2-yl)-5-propylthiophene-3-carboxamide is CCCc1cc(C(=O)Nc2nc(C)cs2)cs1.
What is the InChIKey of N-(4-methyl-1,3-thiazol-2-yl)-5-propylthiophene-3-carboxamide?
The InChIKey is OEZASGCTUFKUTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2OS2/c1-3-4-10-5-9(7-16-10)11(15)14-12-13-8(2)6-17-12/h5-7H,3-4H2,1-2H3,(H,13,14,15).
What are the key properties of N-(4-methyl-1,3-thiazol-2-yl)-5-propylthiophene-3-carboxamide?
N-(4-methyl-1,3-thiazol-2-yl)-5-propylthiophene-3-carboxamide has a molecular weight of 266.39 g/mol, XLogP of 3.72, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-1,3-thiazol-2-yl)-5-propylthiophene-3-carboxamide is sourced from PubChem (CID 25237549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).