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

C11H12N2OS2 — CID 110715967

IUPACN-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]thiophene-2-carboxamide
SMILESCN(CCc1nccs1)C(=O)c1cccs1
InChIInChI=1S/C11H12N2OS2/c1-13(6-4-10-12-5-8-16-10)11(14)9-3-2-7-15-9/h2-3,5,7-8H,4,6H2,1H3
InChIKeyGDSKDJNMLUONSG-UHFFFAOYSA-N
MW252.36 g/mol
LogP2.52
Rot. Bonds4

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

N-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]thiophene-2-carboxamide (PubChem CID 110715967) has the molecular formula C11H12N2OS2 and a molecular weight of 252.36 g/mol. Its IUPAC name is N-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]thiophene-2-carboxamide
PubChem CID110715967
Molecular FormulaC11H12N2OS2
Molecular Weight252.36 g/mol
Exact Mass252.04
IUPAC NameN-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]thiophene-2-carboxamide
SMILESCN(CCc1nccs1)C(=O)c1cccs1
InChIInChI=1S/C11H12N2OS2/c1-13(6-4-10-12-5-8-16-10)11(14)9-3-2-7-15-9/h2-3,5,7-8H,4,6H2,1H3
InChIKeyGDSKDJNMLUONSG-UHFFFAOYSA-N
XLogP2.52
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3,4-dichloro-N-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]benzamide
CID 110715983
4-(dimethylamino)-N-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]benzamide
CID 110742660
N-methyl-2-phenyl-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide
CID 110715989
3-ethyl-1-methyl-1-[2-(1,3-thiazol-2-yl)ethyl]urea
CID 75387967
N-methyl-N-(2-methylsulfanylethyl)thiophene-2-carboxamide
CID 112697982
N-(5-hydroxypentyl)-N-methylthiophene-2-carboxamide
CID 107202244
N-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide
CID 60630814
2-(2-chlorophenyl)-N-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide
CID 110716038
CID 69258575
CID 69258575
3-(3-fluorophenyl)-1-methyl-1-[2-(1,3-thiazol-2-yl)ethyl]urea
CID 71844410
potassium;hydride;N-methyl-N-(pyridin-2-ylmethyl)thiophene-2-carboxamide
CID 173152580
(2S)-2-amino-N,4-dimethyl-N-[2-(1,3-thiazol-2-yl)ethyl]pentanamide;hydrochloride
CID 154752113

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]thiophene-2-carboxamide?
The IUPAC name of N-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]thiophene-2-carboxamide (CID 110715967) is N-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]thiophene-2-carboxamide.
What is the SMILES notation for N-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]thiophene-2-carboxamide?
The canonical SMILES for N-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]thiophene-2-carboxamide is CN(CCc1nccs1)C(=O)c1cccs1.
What is the InChIKey of N-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]thiophene-2-carboxamide?
The InChIKey is GDSKDJNMLUONSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2OS2/c1-13(6-4-10-12-5-8-16-10)11(14)9-3-2-7-15-9/h2-3,5,7-8H,4,6H2,1H3.
What are the key properties of N-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]thiophene-2-carboxamide?
N-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]thiophene-2-carboxamide has a molecular weight of 252.36 g/mol, XLogP of 2.52, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]thiophene-2-carboxamide is sourced from PubChem (CID 110715967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).