N-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide

C15H21NOS — CID 141226976

IUPACN-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
SMILESCC1(C)C(C(=O)Nc2cc3c(s2)CCC3)C1(C)C
InChIInChI=1S/C15H21NOS/c1-14(2)12(15(14,3)4)13(17)16-11-8-9-6-5-7-10(9)18-11/h8,12H,5-7H2,1-4H3,(H,16,17)
InChIKeyWTJIUXADAUJPOX-UHFFFAOYSA-N
MW263.41 g/mol
LogP3.86
Rot. Bonds2

About N-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide

N-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide (PubChem CID 141226976) has the molecular formula C15H21NOS and a molecular weight of 263.41 g/mol. Its IUPAC name is N-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
PubChem CID141226976
Molecular FormulaC15H21NOS
Molecular Weight263.41 g/mol
Exact Mass263.13
IUPAC NameN-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
SMILESCC1(C)C(C(=O)Nc2cc3c(s2)CCC3)C1(C)C
InChIInChI=1S/C15H21NOS/c1-14(2)12(15(14,3)4)13(17)16-11-8-9-6-5-7-10(9)18-11/h8,12H,5-7H2,1-4H3,(H,16,17)
InChIKeyWTJIUXADAUJPOX-UHFFFAOYSA-N
XLogP3.86
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.41
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide with MolForge

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Related Compounds

N-ethyl-2,2,3,3-tetramethyl-N-(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)cyclopropane-1-carboxamide
CID 141226898
N-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2-(4-nitrophenyl)sulfanylacetamide
CID 91027363
2-[(2,2,3,3-tetramethylcyclopropanecarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid
CID 68906817
(Z)-3-[(Z)-but-2-enyl]-N-(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)hept-5-enamide
CID 143029400
N-(3,3-dimethylcyclopentyl)-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide
CID 115881776
N-methyl-2-[(2,2,3,3-tetramethylcyclopropanecarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
CID 68909831
N-ethyl-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide
CID 39903793
N-(4-methylsulfanylphenyl)-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide
CID 9153937
N-[1-(hydroxymethyl)-4-methylcyclohexyl]-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide
CID 62525954
N-(3-aminocyclobutyl)-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide
CID 43595018
N-cyclopentyloxy-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide
CID 83206357
N-(3,3-dimethylcyclopentyl)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxamide
CID 114550474

Frequently Asked Questions

What is the IUPAC name of N-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The IUPAC name of N-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide (CID 141226976) is N-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide.
What is the SMILES notation for N-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The canonical SMILES for N-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide is CC1(C)C(C(=O)Nc2cc3c(s2)CCC3)C1(C)C.
What is the InChIKey of N-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The InChIKey is WTJIUXADAUJPOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NOS/c1-14(2)12(15(14,3)4)13(17)16-11-8-9-6-5-7-10(9)18-11/h8,12H,5-7H2,1-4H3,(H,16,17).
What are the key properties of N-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
N-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide has a molecular weight of 263.41 g/mol, XLogP of 3.86, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide is sourced from PubChem (CID 141226976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).