N-(2-methoxy-2-thiophen-3-ylethyl)pentanamide

C12H19NO2S — CID 90583823

IUPACN-(2-methoxy-2-thiophen-3-ylethyl)pentanamide
SMILESCCCCC(=O)NCC(OC)c1ccsc1
InChIInChI=1S/C12H19NO2S/c1-3-4-5-12(14)13-8-11(15-2)10-6-7-16-9-10/h6-7,9,11H,3-5,8H2,1-2H3,(H,13,14)
InChIKeyWGEZWJZPIKBTLR-UHFFFAOYSA-N
MW241.36 g/mol
LogP2.74
Rot. Bonds7

About N-(2-methoxy-2-thiophen-3-ylethyl)pentanamide

N-(2-methoxy-2-thiophen-3-ylethyl)pentanamide (PubChem CID 90583823) has the molecular formula C12H19NO2S and a molecular weight of 241.36 g/mol. Its IUPAC name is N-(2-methoxy-2-thiophen-3-ylethyl)pentanamide.

Molecular Properties

Compound NameN-(2-methoxy-2-thiophen-3-ylethyl)pentanamide
PubChem CID90583823
Molecular FormulaC12H19NO2S
Molecular Weight241.36 g/mol
Exact Mass241.11
IUPAC NameN-(2-methoxy-2-thiophen-3-ylethyl)pentanamide
SMILESCCCCC(=O)NCC(OC)c1ccsc1
InChIInChI=1S/C12H19NO2S/c1-3-4-5-12(14)13-8-11(15-2)10-6-7-16-9-10/h6-7,9,11H,3-5,8H2,1-2H3,(H,13,14)
InChIKeyWGEZWJZPIKBTLR-UHFFFAOYSA-N
XLogP2.74
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.36
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2S)-2-methoxy-2-thiophen-3-ylethyl]pent-4-enamide
CID 97427131
ethyl N-(2-methoxy-2-thiophen-3-ylethyl)carbamate
CID 71804729
N-(2-methoxy-2-thiophen-3-ylethyl)thiophene-3-carboxamide
CID 71804732
4-ethyl-N-(2-methoxy-2-thiophen-3-ylethyl)benzamide
CID 90583852
N-(2-piperidin-1-yl-2-thiophen-3-ylethyl)pentanamide
CID 16931235
2-(2-methoxyphenoxy)-N-(2-methoxy-2-thiophen-3-ylethyl)acetamide
CID 90583918
1-(2-methoxyethyl)-3-[(2R)-2-methoxy-2-thiophen-3-ylethyl]urea
CID 97414529
2,6-dimethoxy-N-(2-methoxy-2-thiophen-3-ylethyl)benzamide
CID 90583915
1-benzyl-3-[(2R)-2-methoxy-2-thiophen-3-ylethyl]urea
CID 97414533
4-bromo-N-[(2S)-2-methoxy-2-thiophen-3-ylethyl]thiophene-2-carboxamide
CID 97427365
2-ethylsulfanyl-N-[(2R)-2-methoxy-2-thiophen-3-ylethyl]benzamide
CID 97414435
2-bromo-N-(2-methoxy-2-thiophen-3-ylethyl)benzamide
CID 90583943

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-2-thiophen-3-ylethyl)pentanamide?
The IUPAC name of N-(2-methoxy-2-thiophen-3-ylethyl)pentanamide (CID 90583823) is N-(2-methoxy-2-thiophen-3-ylethyl)pentanamide.
What is the SMILES notation for N-(2-methoxy-2-thiophen-3-ylethyl)pentanamide?
The canonical SMILES for N-(2-methoxy-2-thiophen-3-ylethyl)pentanamide is CCCCC(=O)NCC(OC)c1ccsc1.
What is the InChIKey of N-(2-methoxy-2-thiophen-3-ylethyl)pentanamide?
The InChIKey is WGEZWJZPIKBTLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2S/c1-3-4-5-12(14)13-8-11(15-2)10-6-7-16-9-10/h6-7,9,11H,3-5,8H2,1-2H3,(H,13,14).
What are the key properties of N-(2-methoxy-2-thiophen-3-ylethyl)pentanamide?
N-(2-methoxy-2-thiophen-3-ylethyl)pentanamide has a molecular weight of 241.36 g/mol, XLogP of 2.74, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-2-thiophen-3-ylethyl)pentanamide is sourced from PubChem (CID 90583823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).