N-[2-[(2R)-butan-2-yl]phenyl]thiophene-2-sulfonamide

C14H17NO2S2 — CID 7949986

IUPACN-[2-[(2R)-butan-2-yl]phenyl]thiophene-2-sulfonamide
SMILESCC[C@@H](C)c1ccccc1NS(=O)(=O)c1cccs1
InChIInChI=1S/C14H17NO2S2/c1-3-11(2)12-7-4-5-8-13(12)15-19(16,17)14-9-6-10-18-14/h4-11,15H,3H2,1-2H3/t11-/m1/s1
InChIKeyMRBPMJYMQNHWRB-LLVKDONJSA-N
MW295.43 g/mol
LogP4.06
Rot. Bonds5

About N-[2-[(2R)-butan-2-yl]phenyl]thiophene-2-sulfonamide

N-[2-[(2R)-butan-2-yl]phenyl]thiophene-2-sulfonamide (PubChem CID 7949986) has the molecular formula C14H17NO2S2 and a molecular weight of 295.43 g/mol. Its IUPAC name is N-[2-[(2R)-butan-2-yl]phenyl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[2-[(2R)-butan-2-yl]phenyl]thiophene-2-sulfonamide
PubChem CID7949986
Molecular FormulaC14H17NO2S2
Molecular Weight295.43 g/mol
Exact Mass295.07
IUPAC NameN-[2-[(2R)-butan-2-yl]phenyl]thiophene-2-sulfonamide
SMILESCC[C@@H](C)c1ccccc1NS(=O)(=O)c1cccs1
InChIInChI=1S/C14H17NO2S2/c1-3-11(2)12-7-4-5-8-13(12)15-19(16,17)14-9-6-10-18-14/h4-11,15H,3H2,1-2H3/t11-/m1/s1
InChIKeyMRBPMJYMQNHWRB-LLVKDONJSA-N
XLogP4.06
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[(2R)-butan-2-yl]phenyl]-5-chlorothiophene-2-sulfonamide
CID 8025055
N-[2,6-di(propan-2-yl)phenyl]thiophene-2-sulfonamide
CID 769134
1-propan-2-yl-3-[2-(thiophen-2-ylsulfonylamino)phenyl]thiourea
CID 25039011
N-(2-butan-2-ylphenyl)-4-methoxybenzenesulfonamide
CID 3862587
N-[2-(ethylaminomethyl)phenyl]thiophene-2-sulfonamide
CID 43606461
N-(2-butan-2-ylphenyl)-4-fluorobenzenesulfonamide
CID 4678520
N-(2-tert-butylphenyl)thiophene-2-sulfonamide
CID 3861926
N-[(Z)-[(3S)-3-methylpentan-2-ylidene]amino]-2-(thiophen-2-ylsulfonylamino)benzamide
CID 7392702
N-(2-butan-2-ylphenyl)-3-methylbenzenesulfonamide
CID 25036710
N-[2-[(2R)-butan-2-yl]phenyl]-4-(2-methylpropyl)benzenesulfonamide
CID 26012723
N-[1-(2-methoxyphenyl)propyl]-2-[4-(thiophen-2-ylsulfonylamino)phenyl]acetamide
CID 46440676
N-[4-[1-(ethylamino)ethyl]phenyl]thiophene-2-sulfonamide
CID 43508090

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2R)-butan-2-yl]phenyl]thiophene-2-sulfonamide?
The IUPAC name of N-[2-[(2R)-butan-2-yl]phenyl]thiophene-2-sulfonamide (CID 7949986) is N-[2-[(2R)-butan-2-yl]phenyl]thiophene-2-sulfonamide.
What is the SMILES notation for N-[2-[(2R)-butan-2-yl]phenyl]thiophene-2-sulfonamide?
The canonical SMILES for N-[2-[(2R)-butan-2-yl]phenyl]thiophene-2-sulfonamide is CC[C@@H](C)c1ccccc1NS(=O)(=O)c1cccs1.
What is the InChIKey of N-[2-[(2R)-butan-2-yl]phenyl]thiophene-2-sulfonamide?
The InChIKey is MRBPMJYMQNHWRB-LLVKDONJSA-N. The full InChI is InChI=1S/C14H17NO2S2/c1-3-11(2)12-7-4-5-8-13(12)15-19(16,17)14-9-6-10-18-14/h4-11,15H,3H2,1-2H3/t11-/m1/s1.
What are the key properties of N-[2-[(2R)-butan-2-yl]phenyl]thiophene-2-sulfonamide?
N-[2-[(2R)-butan-2-yl]phenyl]thiophene-2-sulfonamide has a molecular weight of 295.43 g/mol, XLogP of 4.06, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2R)-butan-2-yl]phenyl]thiophene-2-sulfonamide is sourced from PubChem (CID 7949986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).