N-(1-hydroxy-2-methylbutan-2-yl)thiophene-3-carboxamide

C10H15NO2S — CID 64556207

IUPACN-(1-hydroxy-2-methylbutan-2-yl)thiophene-3-carboxamide
SMILESCCC(C)(CO)NC(=O)c1ccsc1
InChIInChI=1S/C10H15NO2S/c1-3-10(2,7-12)11-9(13)8-4-5-14-6-8/h4-6,12H,3,7H2,1-2H3,(H,11,13)
InChIKeyYOHXJESZHDBPDR-UHFFFAOYSA-N
MW213.30 g/mol
LogP1.64
Rot. Bonds4

About N-(1-hydroxy-2-methylbutan-2-yl)thiophene-3-carboxamide

N-(1-hydroxy-2-methylbutan-2-yl)thiophene-3-carboxamide (PubChem CID 64556207) has the molecular formula C10H15NO2S and a molecular weight of 213.30 g/mol. Its IUPAC name is N-(1-hydroxy-2-methylbutan-2-yl)thiophene-3-carboxamide.

Molecular Properties

Compound NameN-(1-hydroxy-2-methylbutan-2-yl)thiophene-3-carboxamide
PubChem CID64556207
Molecular FormulaC10H15NO2S
Molecular Weight213.30 g/mol
Exact Mass213.08
IUPAC NameN-(1-hydroxy-2-methylbutan-2-yl)thiophene-3-carboxamide
SMILESCCC(C)(CO)NC(=O)c1ccsc1
InChIInChI=1S/C10H15NO2S/c1-3-10(2,7-12)11-9(13)8-4-5-14-6-8/h4-6,12H,3,7H2,1-2H3,(H,11,13)
InChIKeyYOHXJESZHDBPDR-UHFFFAOYSA-N
XLogP1.64
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.30
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-3-(thiophene-3-carbonylamino)pentanoic acid
CID 115730873
4-(hydroxymethyl)-N-(1-hydroxy-2-methylbutan-2-yl)benzamide
CID 64558344
N-[2-ethyl-2-(hydroxymethyl)butyl]thiophene-3-carboxamide
CID 103843618
5-bromo-N-(1-hydroxy-2-methylbutan-2-yl)thiophene-3-carboxamide
CID 64557581
N-(1-hydroxy-2-methylbutan-2-yl)-3,5-dimethylbenzamide
CID 64558339
N-(1-hydroxy-2-methylbutan-2-yl)-4-methoxybenzamide
CID 64557752
2-hydroxy-2-methyl-1-thiophen-3-ylbutan-1-one
CID 103446763
4-(carbamoylamino)-N-(1-hydroxy-2-methylbutan-2-yl)benzamide
CID 64555959
3-amino-N-(1-hydroxy-2-methylbutan-2-yl)benzamide
CID 64549288
N-(1-hydroxy-2-methylbutan-2-yl)-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide
CID 64557574
N-(2-hydroxy-2-methylpropyl)thiophene-3-carboxamide
CID 65110228
N-(1-hydroxy-2-methylbutan-2-yl)-4-(trifluoromethoxy)benzamide
CID 64555572

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-2-methylbutan-2-yl)thiophene-3-carboxamide?
The IUPAC name of N-(1-hydroxy-2-methylbutan-2-yl)thiophene-3-carboxamide (CID 64556207) is N-(1-hydroxy-2-methylbutan-2-yl)thiophene-3-carboxamide.
What is the SMILES notation for N-(1-hydroxy-2-methylbutan-2-yl)thiophene-3-carboxamide?
The canonical SMILES for N-(1-hydroxy-2-methylbutan-2-yl)thiophene-3-carboxamide is CCC(C)(CO)NC(=O)c1ccsc1.
What is the InChIKey of N-(1-hydroxy-2-methylbutan-2-yl)thiophene-3-carboxamide?
The InChIKey is YOHXJESZHDBPDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2S/c1-3-10(2,7-12)11-9(13)8-4-5-14-6-8/h4-6,12H,3,7H2,1-2H3,(H,11,13).
What are the key properties of N-(1-hydroxy-2-methylbutan-2-yl)thiophene-3-carboxamide?
N-(1-hydroxy-2-methylbutan-2-yl)thiophene-3-carboxamide has a molecular weight of 213.30 g/mol, XLogP of 1.64, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-2-methylbutan-2-yl)thiophene-3-carboxamide is sourced from PubChem (CID 64556207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).