2-ethyl-N-[5-(2-methylpropyl)-1,3-thiazol-2-yl]thiophene-3-carboxamide

C14H18N2OS2 — CID 166349691

IUPAC2-ethyl-N-[5-(2-methylpropyl)-1,3-thiazol-2-yl]thiophene-3-carboxamide
SMILESCCc1sccc1C(=O)Nc1ncc(CC(C)C)s1
InChIInChI=1S/C14H18N2OS2/c1-4-12-11(5-6-18-12)13(17)16-14-15-8-10(19-14)7-9(2)3/h5-6,8-9H,4,7H2,1-3H3,(H,15,16,17)
InChIKeyNUFJCDXVHQMAEA-UHFFFAOYSA-N
MW294.44 g/mol
LogP4.22
Rot. Bonds5

About 2-ethyl-N-[5-(2-methylpropyl)-1,3-thiazol-2-yl]thiophene-3-carboxamide

2-ethyl-N-[5-(2-methylpropyl)-1,3-thiazol-2-yl]thiophene-3-carboxamide (PubChem CID 166349691) has the molecular formula C14H18N2OS2 and a molecular weight of 294.44 g/mol. Its IUPAC name is 2-ethyl-N-[5-(2-methylpropyl)-1,3-thiazol-2-yl]thiophene-3-carboxamide.

Molecular Properties

Compound Name2-ethyl-N-[5-(2-methylpropyl)-1,3-thiazol-2-yl]thiophene-3-carboxamide
PubChem CID166349691
Molecular FormulaC14H18N2OS2
Molecular Weight294.44 g/mol
Exact Mass294.09
IUPAC Name2-ethyl-N-[5-(2-methylpropyl)-1,3-thiazol-2-yl]thiophene-3-carboxamide
SMILESCCc1sccc1C(=O)Nc1ncc(CC(C)C)s1
InChIInChI=1S/C14H18N2OS2/c1-4-12-11(5-6-18-12)13(17)16-14-15-8-10(19-14)7-9(2)3/h5-6,8-9H,4,7H2,1-3H3,(H,15,16,17)
InChIKeyNUFJCDXVHQMAEA-UHFFFAOYSA-N
XLogP4.22
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-bromo-4,5-dimethyl-N-[5-(2-methylpropyl)-1,3-thiazol-2-yl]thiophene-3-carboxamide
CID 167970989
N-[5-(2-methylpropyl)-1,3-thiazol-2-yl]pyrrolidine-1-carboxamide
CID 84587563
2-cyano-N-(5-ethyl-1,3-thiazol-2-yl)benzamide
CID 54382001
ethyl 2-[(5-ethyl-1,3-thiazol-2-yl)carbamoyl]benzoate
CID 54138651
1-[(2R,3S)-4-hydroxy-3-methylbutan-2-yl]-3-[5-(2-methylpropyl)-1,3-thiazol-2-yl]urea
CID 97226993
(5-ethyl-1,3-thiazol-2-yl)carbamic acid
CID 90989275
2-[(5-ethyl-1,3-thiazol-2-yl)carbamoyl]benzenesulfonic acid
CID 54057467
1-(3,5-dimethyl-1H-pyrazol-4-yl)-3-[5-(2-methylpropyl)-1,3-thiazol-2-yl]urea
CID 75514312
(2R)-2-amino-N-(5-ethyl-1,3-thiazol-2-yl)propanamide;hydrochloride
CID 130680042
4-ethyl-N-[5-[(4-ethylphenyl)methyl]-1,3-thiazol-2-yl]benzamide
CID 18876296
2,2-dimethyl-N-[5-(2-methylpropyl)-1,3-thiazol-2-yl]-1-oxo-1,4-thiazinane-4-carboxamide
CID 75427283
methyl 2-ethylthiophene-3-carboxylate
CID 13099127

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[5-(2-methylpropyl)-1,3-thiazol-2-yl]thiophene-3-carboxamide?
The IUPAC name of 2-ethyl-N-[5-(2-methylpropyl)-1,3-thiazol-2-yl]thiophene-3-carboxamide (CID 166349691) is 2-ethyl-N-[5-(2-methylpropyl)-1,3-thiazol-2-yl]thiophene-3-carboxamide.
What is the SMILES notation for 2-ethyl-N-[5-(2-methylpropyl)-1,3-thiazol-2-yl]thiophene-3-carboxamide?
The canonical SMILES for 2-ethyl-N-[5-(2-methylpropyl)-1,3-thiazol-2-yl]thiophene-3-carboxamide is CCc1sccc1C(=O)Nc1ncc(CC(C)C)s1.
What is the InChIKey of 2-ethyl-N-[5-(2-methylpropyl)-1,3-thiazol-2-yl]thiophene-3-carboxamide?
The InChIKey is NUFJCDXVHQMAEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2OS2/c1-4-12-11(5-6-18-12)13(17)16-14-15-8-10(19-14)7-9(2)3/h5-6,8-9H,4,7H2,1-3H3,(H,15,16,17).
What are the key properties of 2-ethyl-N-[5-(2-methylpropyl)-1,3-thiazol-2-yl]thiophene-3-carboxamide?
2-ethyl-N-[5-(2-methylpropyl)-1,3-thiazol-2-yl]thiophene-3-carboxamide has a molecular weight of 294.44 g/mol, XLogP of 4.22, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[5-(2-methylpropyl)-1,3-thiazol-2-yl]thiophene-3-carboxamide is sourced from PubChem (CID 166349691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).