N-benzyl-5-(2-cyclopentyl-1,3-oxazol-5-yl)thiophene-2-sulfonamide

C19H20N2O3S2 — CID 53103169

IUPACN-benzyl-5-(2-cyclopentyl-1,3-oxazol-5-yl)thiophene-2-sulfonamide
SMILESO=S(=O)(NCc1ccccc1)c1ccc(-c2cnc(C3CCCC3)o2)s1
InChIInChI=1S/C19H20N2O3S2/c22-26(23,21-12-14-6-2-1-3-7-14)18-11-10-17(25-18)16-13-20-19(24-16)15-8-4-5-9-15/h1-3,6-7,10-11,13,15,21H,4-5,8-9,12H2
InChIKeyBMDYVHAQNKSTIW-UHFFFAOYSA-N
MW388.51 g/mol
LogP4.54
Rot. Bonds6

About N-benzyl-5-(2-cyclopentyl-1,3-oxazol-5-yl)thiophene-2-sulfonamide

N-benzyl-5-(2-cyclopentyl-1,3-oxazol-5-yl)thiophene-2-sulfonamide (PubChem CID 53103169) has the molecular formula C19H20N2O3S2 and a molecular weight of 388.51 g/mol. Its IUPAC name is N-benzyl-5-(2-cyclopentyl-1,3-oxazol-5-yl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-benzyl-5-(2-cyclopentyl-1,3-oxazol-5-yl)thiophene-2-sulfonamide
PubChem CID53103169
Molecular FormulaC19H20N2O3S2
Molecular Weight388.51 g/mol
Exact Mass388.09
IUPAC NameN-benzyl-5-(2-cyclopentyl-1,3-oxazol-5-yl)thiophene-2-sulfonamide
SMILESO=S(=O)(NCc1ccccc1)c1ccc(-c2cnc(C3CCCC3)o2)s1
InChIInChI=1S/C19H20N2O3S2/c22-26(23,21-12-14-6-2-1-3-7-14)18-11-10-17(25-18)16-13-20-19(24-16)15-8-4-5-9-15/h1-3,6-7,10-11,13,15,21H,4-5,8-9,12H2
InChIKeyBMDYVHAQNKSTIW-UHFFFAOYSA-N
XLogP4.54
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.51
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(2-cyclopentyl-1,3-oxazol-5-yl)-N-[[4-(dimethylamino)phenyl]methyl]thiophene-2-sulfonamide
CID 53103180
5-(2-cyclopropyl-1,3-oxazol-5-yl)-N-[(3-methylphenyl)methyl]thiophene-2-sulfonamide
CID 53102955
5-(2-cyclopropyl-1,3-oxazol-5-yl)-N-[(2-methylphenyl)methyl]thiophene-2-sulfonamide
CID 53102953
5-(2-cyclobutyl-1,3-oxazol-5-yl)-N-[(2-ethoxyphenyl)methyl]thiophene-2-sulfonamide
CID 53103065
5-(2-cyclobutyl-1,3-oxazol-5-yl)-N-[(5-methylfuran-2-yl)methyl]thiophene-2-sulfonamide
CID 53103047
5-(2-cyclopentyl-1,3-oxazol-5-yl)-N-(2,6-dimethylphenyl)thiophene-2-sulfonamide
CID 53103094
5-(2-cyclopentyl-1,3-oxazol-5-yl)-N-(2,3-dimethylphenyl)thiophene-2-sulfonamide
CID 53103093
5-(2-cyclobutyl-1,3-oxazol-5-yl)-N-(4-fluorophenyl)thiophene-2-sulfonamide
CID 53102984
2-cyclopentyl-5-[5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)thiophen-2-yl]-1,3-oxazole
CID 20971715
5-(2-cyclobutyl-1,3-oxazol-5-yl)-N-(2,4,6-trimethylphenyl)thiophene-2-sulfonamide
CID 53103014
5-(2-cyclopropyl-1,3-oxazol-5-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)thiophene-2-sulfonamide
CID 53102929
5-(2-cyclopropyl-1,3-oxazol-5-yl)-N-(4-ethoxyphenyl)thiophene-2-sulfonamide
CID 53102898

Frequently Asked Questions

What is the IUPAC name of N-benzyl-5-(2-cyclopentyl-1,3-oxazol-5-yl)thiophene-2-sulfonamide?
The IUPAC name of N-benzyl-5-(2-cyclopentyl-1,3-oxazol-5-yl)thiophene-2-sulfonamide (CID 53103169) is N-benzyl-5-(2-cyclopentyl-1,3-oxazol-5-yl)thiophene-2-sulfonamide.
What is the SMILES notation for N-benzyl-5-(2-cyclopentyl-1,3-oxazol-5-yl)thiophene-2-sulfonamide?
The canonical SMILES for N-benzyl-5-(2-cyclopentyl-1,3-oxazol-5-yl)thiophene-2-sulfonamide is O=S(=O)(NCc1ccccc1)c1ccc(-c2cnc(C3CCCC3)o2)s1.
What is the InChIKey of N-benzyl-5-(2-cyclopentyl-1,3-oxazol-5-yl)thiophene-2-sulfonamide?
The InChIKey is BMDYVHAQNKSTIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O3S2/c22-26(23,21-12-14-6-2-1-3-7-14)18-11-10-17(25-18)16-13-20-19(24-16)15-8-4-5-9-15/h1-3,6-7,10-11,13,15,21H,4-5,8-9,12H2.
What are the key properties of N-benzyl-5-(2-cyclopentyl-1,3-oxazol-5-yl)thiophene-2-sulfonamide?
N-benzyl-5-(2-cyclopentyl-1,3-oxazol-5-yl)thiophene-2-sulfonamide has a molecular weight of 388.51 g/mol, XLogP of 4.54, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-5-(2-cyclopentyl-1,3-oxazol-5-yl)thiophene-2-sulfonamide is sourced from PubChem (CID 53103169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).