N-[(2S)-1-(furan-2-yl)propan-2-yl]-4-(pyrrolidine-1-carbonyl)thiophene-2-sulfonamide

C16H20N2O4S2 — CID 93056586

IUPACN-[(2S)-1-(furan-2-yl)propan-2-yl]-4-(pyrrolidine-1-carbonyl)thiophene-2-sulfonamide
SMILESC[C@@H](Cc1ccco1)NS(=O)(=O)c1cc(C(=O)N2CCCC2)cs1
InChIInChI=1S/C16H20N2O4S2/c1-12(9-14-5-4-8-22-14)17-24(20,21)15-10-13(11-23-15)16(19)18-6-2-3-7-18/h4-5,8,10-12,17H,2-3,6-7,9H2,1H3/t12-/m0/s1
InChIKeyMWRIGARXQMVPPZ-LBPRGKRZSA-N
MW368.48 g/mol
LogP2.49
Rot. Bonds6

About N-[(2S)-1-(furan-2-yl)propan-2-yl]-4-(pyrrolidine-1-carbonyl)thiophene-2-sulfonamide

N-[(2S)-1-(furan-2-yl)propan-2-yl]-4-(pyrrolidine-1-carbonyl)thiophene-2-sulfonamide (PubChem CID 93056586) has the molecular formula C16H20N2O4S2 and a molecular weight of 368.48 g/mol. Its IUPAC name is N-[(2S)-1-(furan-2-yl)propan-2-yl]-4-(pyrrolidine-1-carbonyl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[(2S)-1-(furan-2-yl)propan-2-yl]-4-(pyrrolidine-1-carbonyl)thiophene-2-sulfonamide
PubChem CID93056586
Molecular FormulaC16H20N2O4S2
Molecular Weight368.48 g/mol
Exact Mass368.09
IUPAC NameN-[(2S)-1-(furan-2-yl)propan-2-yl]-4-(pyrrolidine-1-carbonyl)thiophene-2-sulfonamide
SMILESC[C@@H](Cc1ccco1)NS(=O)(=O)c1cc(C(=O)N2CCCC2)cs1
InChIInChI=1S/C16H20N2O4S2/c1-12(9-14-5-4-8-22-14)17-24(20,21)15-10-13(11-23-15)16(19)18-6-2-3-7-18/h4-5,8,10-12,17H,2-3,6-7,9H2,1H3/t12-/m0/s1
InChIKeyMWRIGARXQMVPPZ-LBPRGKRZSA-N
XLogP2.49
TPSA79.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.48
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(2S)-1-(furan-2-yl)propan-2-yl]-4-(pyrrolidine-1-carbonyl)thiophene-2-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(2R)-1-(furan-2-yl)propan-2-yl]-4-[4-methyl-5-(piperidine-1-carbonyl)-1,3-thiazol-2-yl]thiophene-2-sulfonamide
CID 95092654
N-[(2R)-1-(furan-2-yl)propan-2-yl]-5-methylthiophene-2-sulfonamide
CID 34161122
N-(2-phenylpropyl)-4-(pyrrolidine-1-carbonyl)thiophene-2-sulfonamide
CID 50777620
5-[[(1S)-1-(furan-2-yl)ethyl]sulfamoyl]thiophene-3-carboxylic acid
CID 81409119
N-[(2S)-butan-2-yl]-4-[5-(piperidine-1-carbonyl)-1,3,4-oxadiazol-2-yl]thiophene-2-sulfonamide
CID 95092174
4-[1-(furan-2-yl)propan-2-ylsulfamoyl]-N-methylbenzamide
CID 51078414
N-[1-(furan-2-yl)propan-2-yl]piperidin-1-amine
CID 83006470
N-(3-acetylphenyl)-4-(azepane-1-carbonyl)thiophene-2-sulfonamide
CID 50777717
3-(pyrrolidine-1-carbonyl)-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide
CID 47956493
N-[1-(furan-2-yl)propan-2-yl]-3-hydroxybenzenesulfonamide
CID 81258780
N-(3-methylphenyl)-4-(pyrrolidine-1-carbonyl)thiophene-2-sulfonamide
CID 50806760
4-(azepane-1-carbonyl)-N-(4-methyl-2-pyridinyl)thiophene-2-sulfonamide
CID 50777609

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-1-(furan-2-yl)propan-2-yl]-4-(pyrrolidine-1-carbonyl)thiophene-2-sulfonamide?
The IUPAC name of N-[(2S)-1-(furan-2-yl)propan-2-yl]-4-(pyrrolidine-1-carbonyl)thiophene-2-sulfonamide (CID 93056586) is N-[(2S)-1-(furan-2-yl)propan-2-yl]-4-(pyrrolidine-1-carbonyl)thiophene-2-sulfonamide.
What is the SMILES notation for N-[(2S)-1-(furan-2-yl)propan-2-yl]-4-(pyrrolidine-1-carbonyl)thiophene-2-sulfonamide?
The canonical SMILES for N-[(2S)-1-(furan-2-yl)propan-2-yl]-4-(pyrrolidine-1-carbonyl)thiophene-2-sulfonamide is C[C@@H](Cc1ccco1)NS(=O)(=O)c1cc(C(=O)N2CCCC2)cs1.
What is the InChIKey of N-[(2S)-1-(furan-2-yl)propan-2-yl]-4-(pyrrolidine-1-carbonyl)thiophene-2-sulfonamide?
The InChIKey is MWRIGARXQMVPPZ-LBPRGKRZSA-N. The full InChI is InChI=1S/C16H20N2O4S2/c1-12(9-14-5-4-8-22-14)17-24(20,21)15-10-13(11-23-15)16(19)18-6-2-3-7-18/h4-5,8,10-12,17H,2-3,6-7,9H2,1H3/t12-/m0/s1.
What are the key properties of N-[(2S)-1-(furan-2-yl)propan-2-yl]-4-(pyrrolidine-1-carbonyl)thiophene-2-sulfonamide?
N-[(2S)-1-(furan-2-yl)propan-2-yl]-4-(pyrrolidine-1-carbonyl)thiophene-2-sulfonamide has a molecular weight of 368.48 g/mol, XLogP of 2.49, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-1-(furan-2-yl)propan-2-yl]-4-(pyrrolidine-1-carbonyl)thiophene-2-sulfonamide is sourced from PubChem (CID 93056586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).