3-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)thiophene-2-carboxamide

C11H16N2O2S — CID 114628267

IUPAC3-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)thiophene-2-carboxamide
SMILESCC1(C)C(O)CC1NC(=O)c1sccc1N
InChIInChI=1S/C11H16N2O2S/c1-11(2)7(5-8(11)14)13-10(15)9-6(12)3-4-16-9/h3-4,7-8,14H,5,12H2,1-2H3,(H,13,15)
InChIKeySIDSSRWTBOJBAX-UHFFFAOYSA-N
MW240.33 g/mol
LogP1.22
Rot. Bonds2

About 3-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)thiophene-2-carboxamide

3-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)thiophene-2-carboxamide (PubChem CID 114628267) has the molecular formula C11H16N2O2S and a molecular weight of 240.33 g/mol. Its IUPAC name is 3-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)thiophene-2-carboxamide
PubChem CID114628267
Molecular FormulaC11H16N2O2S
Molecular Weight240.33 g/mol
Exact Mass240.09
IUPAC Name3-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)thiophene-2-carboxamide
SMILESCC1(C)C(O)CC1NC(=O)c1sccc1N
InChIInChI=1S/C11H16N2O2S/c1-11(2)7(5-8(11)14)13-10(15)9-6(12)3-4-16-9/h3-4,7-8,14H,5,12H2,1-2H3,(H,13,15)
InChIKeySIDSSRWTBOJBAX-UHFFFAOYSA-N
XLogP1.22
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.33
LogP ≤ 51.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-hydroxy-2,2-dimethylcyclobutyl)-3-phenylthiophene-2-carboxamide
CID 114631082
7-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)thieno[2,3-b]pyrazine-6-carboxamide
CID 114632820
3-[[(3-hydroxy-2,2-dimethylcyclobutyl)amino]methyl]thiophene-2-carboxylic acid
CID 103267220
5-amino-2,4-difluoro-N-(3-hydroxy-2,2-dimethylcyclobutyl)benzamide
CID 114628200
3-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)-1H-1,2,4-triazole-5-carboxamide
CID 114629744
2-(2-aminophenyl)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide
CID 114628289
3-amino-N-(2,4-dimethylcyclohexyl)thiophene-2-carboxamide
CID 63996432
4-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)-1-methylpyrazole-5-carboxamide
CID 114628278
4-(2-aminoethyl)-N-(3-hydroxy-2,2-dimethylcyclobutyl)benzamide
CID 114629766
2-[(3-hydroxy-2,2-dimethylcyclobutyl)carbamoylamino]thiophene-3-carboxylic acid
CID 114630339
2-fluoro-6-hydroxy-N-(3-hydroxy-2,2-dimethylcyclobutyl)benzamide
CID 104956514
3-amino-5-fluoro-N-(3-hydroxy-2,2-dimethylcyclobutyl)benzamide
CID 114628218

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)thiophene-2-carboxamide?
The IUPAC name of 3-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)thiophene-2-carboxamide (CID 114628267) is 3-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)thiophene-2-carboxamide.
What is the SMILES notation for 3-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)thiophene-2-carboxamide?
The canonical SMILES for 3-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)thiophene-2-carboxamide is CC1(C)C(O)CC1NC(=O)c1sccc1N.
What is the InChIKey of 3-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)thiophene-2-carboxamide?
The InChIKey is SIDSSRWTBOJBAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2S/c1-11(2)7(5-8(11)14)13-10(15)9-6(12)3-4-16-9/h3-4,7-8,14H,5,12H2,1-2H3,(H,13,15).
What are the key properties of 3-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)thiophene-2-carboxamide?
3-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)thiophene-2-carboxamide has a molecular weight of 240.33 g/mol, XLogP of 1.22, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)thiophene-2-carboxamide is sourced from PubChem (CID 114628267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).