N-(benzenesulfonyl)-2-(furan-2-yl)cyclopropane-1-carboxamide

C14H13NO4S — CID 47457570

IUPACN-(benzenesulfonyl)-2-(furan-2-yl)cyclopropane-1-carboxamide
SMILESO=C(NS(=O)(=O)c1ccccc1)C1CC1c1ccco1
InChIInChI=1S/C14H13NO4S/c16-14(12-9-11(12)13-7-4-8-19-13)15-20(17,18)10-5-2-1-3-6-10/h1-8,11-12H,9H2,(H,15,16)
InChIKeyFHCZRHUOXAHDQU-UHFFFAOYSA-N
MW291.33 g/mol
LogP1.89
Rot. Bonds4

About N-(benzenesulfonyl)-2-(furan-2-yl)cyclopropane-1-carboxamide

N-(benzenesulfonyl)-2-(furan-2-yl)cyclopropane-1-carboxamide (PubChem CID 47457570) has the molecular formula C14H13NO4S and a molecular weight of 291.33 g/mol. Its IUPAC name is N-(benzenesulfonyl)-2-(furan-2-yl)cyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(benzenesulfonyl)-2-(furan-2-yl)cyclopropane-1-carboxamide
PubChem CID47457570
Molecular FormulaC14H13NO4S
Molecular Weight291.33 g/mol
Exact Mass291.06
IUPAC NameN-(benzenesulfonyl)-2-(furan-2-yl)cyclopropane-1-carboxamide
SMILESO=C(NS(=O)(=O)c1ccccc1)C1CC1c1ccco1
InChIInChI=1S/C14H13NO4S/c16-14(12-9-11(12)13-7-4-8-19-13)15-20(17,18)10-5-2-1-3-6-10/h1-8,11-12H,9H2,(H,15,16)
InChIKeyFHCZRHUOXAHDQU-UHFFFAOYSA-N
XLogP1.89
TPSA76.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.33
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(benzenesulfonyl)-2-(furan-2-yl)cyclopropane-1-carboxamide?
The IUPAC name of N-(benzenesulfonyl)-2-(furan-2-yl)cyclopropane-1-carboxamide (CID 47457570) is N-(benzenesulfonyl)-2-(furan-2-yl)cyclopropane-1-carboxamide.
What is the SMILES notation for N-(benzenesulfonyl)-2-(furan-2-yl)cyclopropane-1-carboxamide?
The canonical SMILES for N-(benzenesulfonyl)-2-(furan-2-yl)cyclopropane-1-carboxamide is O=C(NS(=O)(=O)c1ccccc1)C1CC1c1ccco1.
What is the InChIKey of N-(benzenesulfonyl)-2-(furan-2-yl)cyclopropane-1-carboxamide?
The InChIKey is FHCZRHUOXAHDQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO4S/c16-14(12-9-11(12)13-7-4-8-19-13)15-20(17,18)10-5-2-1-3-6-10/h1-8,11-12H,9H2,(H,15,16).
What are the key properties of N-(benzenesulfonyl)-2-(furan-2-yl)cyclopropane-1-carboxamide?
N-(benzenesulfonyl)-2-(furan-2-yl)cyclopropane-1-carboxamide has a molecular weight of 291.33 g/mol, XLogP of 1.89, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(benzenesulfonyl)-2-(furan-2-yl)cyclopropane-1-carboxamide is sourced from PubChem (CID 47457570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).