N-(2-methoxy-2-thiophen-3-ylethyl)thiophene-3-carboxamide

C12H13NO2S2 — CID 71804732

IUPACN-(2-methoxy-2-thiophen-3-ylethyl)thiophene-3-carboxamide
SMILESCOC(CNC(=O)c1ccsc1)c1ccsc1
InChIInChI=1S/C12H13NO2S2/c1-15-11(9-2-4-16-7-9)6-13-12(14)10-3-5-17-8-10/h2-5,7-8,11H,6H2,1H3,(H,13,14)
InChIKeyYTHRURIFQFGMQV-UHFFFAOYSA-N
MW267.38 g/mol
LogP2.93
Rot. Bonds5

About N-(2-methoxy-2-thiophen-3-ylethyl)thiophene-3-carboxamide

N-(2-methoxy-2-thiophen-3-ylethyl)thiophene-3-carboxamide (PubChem CID 71804732) has the molecular formula C12H13NO2S2 and a molecular weight of 267.38 g/mol. Its IUPAC name is N-(2-methoxy-2-thiophen-3-ylethyl)thiophene-3-carboxamide.

Molecular Properties

Compound NameN-(2-methoxy-2-thiophen-3-ylethyl)thiophene-3-carboxamide
PubChem CID71804732
Molecular FormulaC12H13NO2S2
Molecular Weight267.38 g/mol
Exact Mass267.04
IUPAC NameN-(2-methoxy-2-thiophen-3-ylethyl)thiophene-3-carboxamide
SMILESCOC(CNC(=O)c1ccsc1)c1ccsc1
InChIInChI=1S/C12H13NO2S2/c1-15-11(9-2-4-16-7-9)6-13-12(14)10-3-5-17-8-10/h2-5,7-8,11H,6H2,1H3,(H,13,14)
InChIKeyYTHRURIFQFGMQV-UHFFFAOYSA-N
XLogP2.93
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.38
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-ethyl-N-(2-methoxy-2-thiophen-3-ylethyl)benzamide
CID 90583852
N-(2-methoxy-2-thiophen-3-ylethyl)-4-phenoxybenzamide
CID 90583960
2,6-dimethoxy-N-(2-methoxy-2-thiophen-3-ylethyl)benzamide
CID 90583915
4-bromo-N-[(2S)-2-methoxy-2-thiophen-3-ylethyl]thiophene-2-carboxamide
CID 97427365
ethyl N-(2-methoxy-2-thiophen-3-ylethyl)carbamate
CID 71804729
1-(2-methoxyethyl)-3-[(2R)-2-methoxy-2-thiophen-3-ylethyl]urea
CID 97414529
2-bromo-N-(2-methoxy-2-thiophen-3-ylethyl)benzamide
CID 90583943
2-ethylsulfanyl-N-[(2R)-2-methoxy-2-thiophen-3-ylethyl]benzamide
CID 97414435
N-(2-methoxy-2-thiophen-3-ylethyl)pentanamide
CID 90583823
2-bromo-5-methoxy-N-(2-methoxy-2-thiophen-3-ylethyl)benzamide
CID 90583971
N-(2-chloro-3-methoxypropyl)thiophene-3-carboxamide
CID 114298911
N-[(2S)-2-methoxy-2-thiophen-3-ylethyl]pent-4-enamide
CID 97427131

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-2-thiophen-3-ylethyl)thiophene-3-carboxamide?
The IUPAC name of N-(2-methoxy-2-thiophen-3-ylethyl)thiophene-3-carboxamide (CID 71804732) is N-(2-methoxy-2-thiophen-3-ylethyl)thiophene-3-carboxamide.
What is the SMILES notation for N-(2-methoxy-2-thiophen-3-ylethyl)thiophene-3-carboxamide?
The canonical SMILES for N-(2-methoxy-2-thiophen-3-ylethyl)thiophene-3-carboxamide is COC(CNC(=O)c1ccsc1)c1ccsc1.
What is the InChIKey of N-(2-methoxy-2-thiophen-3-ylethyl)thiophene-3-carboxamide?
The InChIKey is YTHRURIFQFGMQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO2S2/c1-15-11(9-2-4-16-7-9)6-13-12(14)10-3-5-17-8-10/h2-5,7-8,11H,6H2,1H3,(H,13,14).
What are the key properties of N-(2-methoxy-2-thiophen-3-ylethyl)thiophene-3-carboxamide?
N-(2-methoxy-2-thiophen-3-ylethyl)thiophene-3-carboxamide has a molecular weight of 267.38 g/mol, XLogP of 2.93, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-2-thiophen-3-ylethyl)thiophene-3-carboxamide is sourced from PubChem (CID 71804732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).