4-hydroxy-N-(2-thiophen-2-ylethyl)butanamide

C10H15NO2S — CID 13185709

IUPAC4-hydroxy-N-(2-thiophen-2-ylethyl)butanamide
SMILESO=C(CCCO)NCCc1cccs1
InChIInChI=1S/C10H15NO2S/c12-7-1-4-10(13)11-6-5-9-3-2-8-14-9/h2-3,8,12H,1,4-7H2,(H,11,13)
InChIKeyNCXMEZYTUOAUFL-UHFFFAOYSA-N
MW213.30 g/mol
LogP1.18
Rot. Bonds6

About 4-hydroxy-N-(2-thiophen-2-ylethyl)butanamide

4-hydroxy-N-(2-thiophen-2-ylethyl)butanamide (PubChem CID 13185709) has the molecular formula C10H15NO2S and a molecular weight of 213.30 g/mol. Its IUPAC name is 4-hydroxy-N-(2-thiophen-2-ylethyl)butanamide.

Molecular Properties

Compound Name4-hydroxy-N-(2-thiophen-2-ylethyl)butanamide
PubChem CID13185709
Molecular FormulaC10H15NO2S
Molecular Weight213.30 g/mol
Exact Mass213.08
IUPAC Name4-hydroxy-N-(2-thiophen-2-ylethyl)butanamide
SMILESO=C(CCCO)NCCc1cccs1
InChIInChI=1S/C10H15NO2S/c12-7-1-4-10(13)11-6-5-9-3-2-8-14-9/h2-3,8,12H,1,4-7H2,(H,11,13)
InChIKeyNCXMEZYTUOAUFL-UHFFFAOYSA-N
XLogP1.18
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.30
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-hydroxy-N-(2-thiophen-2-ylethyl)acetamide
CID 13454159
3-bromo-N-(2-thiophen-2-ylethyl)propanamide
CID 82109303
5-oxo-N-(3-thiophen-2-ylpropyl)hexanamide
CID 144920925
N-[2-(methylamino)ethyl]-6-thiophen-2-ylhexanamide
CID 119500853
2-[ethyl(3-hydroxypropyl)amino]-N-(2-thiophen-2-ylethyl)acetamide
CID 115666347
N-hexyl-4-thiophen-2-ylbutanamide
CID 134055852
N-[2-(4-aminophenyl)ethyl]-4-thiophen-2-ylbutanamide;hydrochloride
CID 119549554
5-(3-thiophen-2-ylpropanoylamino)pentanoic acid
CID 62031946
N-pent-4-ynyl-4-thiophen-2-ylbutanamide
CID 103708912
N-[2-(ethylamino)ethyl]-6-thiophen-2-ylhexanamide
CID 119505635
N-(3-aminobutyl)-4-thiophen-2-ylbutanamide
CID 63253791
N-(4-cyanobutyl)-4-thiophen-2-ylbutanamide
CID 63284935

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(2-thiophen-2-ylethyl)butanamide?
The IUPAC name of 4-hydroxy-N-(2-thiophen-2-ylethyl)butanamide (CID 13185709) is 4-hydroxy-N-(2-thiophen-2-ylethyl)butanamide.
What is the SMILES notation for 4-hydroxy-N-(2-thiophen-2-ylethyl)butanamide?
The canonical SMILES for 4-hydroxy-N-(2-thiophen-2-ylethyl)butanamide is O=C(CCCO)NCCc1cccs1.
What is the InChIKey of 4-hydroxy-N-(2-thiophen-2-ylethyl)butanamide?
The InChIKey is NCXMEZYTUOAUFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2S/c12-7-1-4-10(13)11-6-5-9-3-2-8-14-9/h2-3,8,12H,1,4-7H2,(H,11,13).
What are the key properties of 4-hydroxy-N-(2-thiophen-2-ylethyl)butanamide?
4-hydroxy-N-(2-thiophen-2-ylethyl)butanamide has a molecular weight of 213.30 g/mol, XLogP of 1.18, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(2-thiophen-2-ylethyl)butanamide is sourced from PubChem (CID 13185709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).