N-pentan-2-yl-2-(5-sulfamoylthiophen-2-yl)acetamide

C11H18N2O3S2 — CID 47166864

IUPACN-pentan-2-yl-2-(5-sulfamoylthiophen-2-yl)acetamide
SMILESCCCC(C)NC(=O)Cc1ccc(S(N)(=O)=O)s1
InChIInChI=1S/C11H18N2O3S2/c1-3-4-8(2)13-10(14)7-9-5-6-11(17-9)18(12,15)16/h5-6,8H,3-4,7H2,1-2H3,(H,13,14)(H2,12,15,16)
InChIKeyGYAJKSSIBKHTEX-UHFFFAOYSA-N
MW290.41 g/mol
LogP1.24
Rot. Bonds6

About N-pentan-2-yl-2-(5-sulfamoylthiophen-2-yl)acetamide

N-pentan-2-yl-2-(5-sulfamoylthiophen-2-yl)acetamide (PubChem CID 47166864) has the molecular formula C11H18N2O3S2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-pentan-2-yl-2-(5-sulfamoylthiophen-2-yl)acetamide.

Molecular Properties

Compound NameN-pentan-2-yl-2-(5-sulfamoylthiophen-2-yl)acetamide
PubChem CID47166864
Molecular FormulaC11H18N2O3S2
Molecular Weight290.41 g/mol
Exact Mass290.08
IUPAC NameN-pentan-2-yl-2-(5-sulfamoylthiophen-2-yl)acetamide
SMILESCCCC(C)NC(=O)Cc1ccc(S(N)(=O)=O)s1
InChIInChI=1S/C11H18N2O3S2/c1-3-4-8(2)13-10(14)7-9-5-6-11(17-9)18(12,15)16/h5-6,8H,3-4,7H2,1-2H3,(H,13,14)(H2,12,15,16)
InChIKeyGYAJKSSIBKHTEX-UHFFFAOYSA-N
XLogP1.24
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-methoxybutan-2-yl)-2-(5-sulfamoylthiophen-2-yl)acetamide
CID 64689300
N-(2,3-dimethylbutyl)-2-(5-sulfamoylthiophen-2-yl)acetamide
CID 64723560
N-(2-methylbutan-2-yl)-2-(5-sulfamoylthiophen-2-yl)acetamide
CID 39007502
methyl 2-(5-sulfamoylthiophen-2-yl)acetate
CID 60753569
N-(4-ethylcyclohexyl)-2-(5-sulfamoylthiophen-2-yl)acetamide
CID 60759072
5-[2-(3-ethylpentan-2-ylamino)-2-oxoethyl]thiophene-2-sulfonyl chloride
CID 65396098
N-[1-(5-sulfamoylthiophen-2-yl)ethyl]butanamide
CID 43133919
N,N-diethyl-2-(5-sulfamoylthiophen-2-yl)acetamide
CID 61068995
N-(4,4-dimethylcyclohexyl)-2-(5-sulfamoylthiophen-2-yl)acetamide
CID 65382614
N-propyl-4-[[2-(5-sulfamoylthiophen-2-yl)acetyl]amino]benzamide
CID 154835109
N-[2-(5-sulfamoylthiophen-2-yl)ethyl]butanamide
CID 43133898
5-(aminomethyl)-N-pentan-2-ylthiophene-2-sulfonamide
CID 43155699

Frequently Asked Questions

What is the IUPAC name of N-pentan-2-yl-2-(5-sulfamoylthiophen-2-yl)acetamide?
The IUPAC name of N-pentan-2-yl-2-(5-sulfamoylthiophen-2-yl)acetamide (CID 47166864) is N-pentan-2-yl-2-(5-sulfamoylthiophen-2-yl)acetamide.
What is the SMILES notation for N-pentan-2-yl-2-(5-sulfamoylthiophen-2-yl)acetamide?
The canonical SMILES for N-pentan-2-yl-2-(5-sulfamoylthiophen-2-yl)acetamide is CCCC(C)NC(=O)Cc1ccc(S(N)(=O)=O)s1.
What is the InChIKey of N-pentan-2-yl-2-(5-sulfamoylthiophen-2-yl)acetamide?
The InChIKey is GYAJKSSIBKHTEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O3S2/c1-3-4-8(2)13-10(14)7-9-5-6-11(17-9)18(12,15)16/h5-6,8H,3-4,7H2,1-2H3,(H,13,14)(H2,12,15,16).
What are the key properties of N-pentan-2-yl-2-(5-sulfamoylthiophen-2-yl)acetamide?
N-pentan-2-yl-2-(5-sulfamoylthiophen-2-yl)acetamide has a molecular weight of 290.41 g/mol, XLogP of 1.24, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-pentan-2-yl-2-(5-sulfamoylthiophen-2-yl)acetamide is sourced from PubChem (CID 47166864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).