1-phenyl-N-(2-thiophen-2-ylcyclopropyl)methanesulfonamide

C14H15NO2S2 — CID 110711308

IUPAC1-phenyl-N-(2-thiophen-2-ylcyclopropyl)methanesulfonamide
SMILESO=S(=O)(Cc1ccccc1)NC1CC1c1cccs1
InChIInChI=1S/C14H15NO2S2/c16-19(17,10-11-5-2-1-3-6-11)15-13-9-12(13)14-7-4-8-18-14/h1-8,12-13,15H,9-10H2
InChIKeyCRTBVYRIZXDMQD-UHFFFAOYSA-N
MW293.41 g/mol
LogP2.72
Rot. Bonds5

About 1-phenyl-N-(2-thiophen-2-ylcyclopropyl)methanesulfonamide

1-phenyl-N-(2-thiophen-2-ylcyclopropyl)methanesulfonamide (PubChem CID 110711308) has the molecular formula C14H15NO2S2 and a molecular weight of 293.41 g/mol. Its IUPAC name is 1-phenyl-N-(2-thiophen-2-ylcyclopropyl)methanesulfonamide.

Molecular Properties

Compound Name1-phenyl-N-(2-thiophen-2-ylcyclopropyl)methanesulfonamide
PubChem CID110711308
Molecular FormulaC14H15NO2S2
Molecular Weight293.41 g/mol
Exact Mass293.05
IUPAC Name1-phenyl-N-(2-thiophen-2-ylcyclopropyl)methanesulfonamide
SMILESO=S(=O)(Cc1ccccc1)NC1CC1c1cccs1
InChIInChI=1S/C14H15NO2S2/c16-19(17,10-11-5-2-1-3-6-11)15-13-9-12(13)14-7-4-8-18-14/h1-8,12-13,15H,9-10H2
InChIKeyCRTBVYRIZXDMQD-UHFFFAOYSA-N
XLogP2.72
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-phenyl-N-(2-thiophen-2-ylcyclopropyl)methanesulfonamide?
The IUPAC name of 1-phenyl-N-(2-thiophen-2-ylcyclopropyl)methanesulfonamide (CID 110711308) is 1-phenyl-N-(2-thiophen-2-ylcyclopropyl)methanesulfonamide.
What is the SMILES notation for 1-phenyl-N-(2-thiophen-2-ylcyclopropyl)methanesulfonamide?
The canonical SMILES for 1-phenyl-N-(2-thiophen-2-ylcyclopropyl)methanesulfonamide is O=S(=O)(Cc1ccccc1)NC1CC1c1cccs1.
What is the InChIKey of 1-phenyl-N-(2-thiophen-2-ylcyclopropyl)methanesulfonamide?
The InChIKey is CRTBVYRIZXDMQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2S2/c16-19(17,10-11-5-2-1-3-6-11)15-13-9-12(13)14-7-4-8-18-14/h1-8,12-13,15H,9-10H2.
What are the key properties of 1-phenyl-N-(2-thiophen-2-ylcyclopropyl)methanesulfonamide?
1-phenyl-N-(2-thiophen-2-ylcyclopropyl)methanesulfonamide has a molecular weight of 293.41 g/mol, XLogP of 2.72, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-N-(2-thiophen-2-ylcyclopropyl)methanesulfonamide is sourced from PubChem (CID 110711308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).