2-(furan-2-yl)-N-[1-[2-(methanesulfonamido)phenyl]ethyl]cyclopropane-1-carboxamide

C17H20N2O4S — CID 86852835

IUPAC2-(furan-2-yl)-N-[1-[2-(methanesulfonamido)phenyl]ethyl]cyclopropane-1-carboxamide
SMILESCC(NC(=O)C1CC1c1ccco1)c1ccccc1NS(C)(=O)=O
InChIInChI=1S/C17H20N2O4S/c1-11(12-6-3-4-7-15(12)19-24(2,21)22)18-17(20)14-10-13(14)16-8-5-9-23-16/h3-9,11,13-14,19H,10H2,1-2H3,(H,18,20)
InChIKeyPQQSKDFMKHJLSG-UHFFFAOYSA-N
MW348.42 g/mol
LogP2.63
Rot. Bonds6

About 2-(furan-2-yl)-N-[1-[2-(methanesulfonamido)phenyl]ethyl]cyclopropane-1-carboxamide

2-(furan-2-yl)-N-[1-[2-(methanesulfonamido)phenyl]ethyl]cyclopropane-1-carboxamide (PubChem CID 86852835) has the molecular formula C17H20N2O4S and a molecular weight of 348.42 g/mol. Its IUPAC name is 2-(furan-2-yl)-N-[1-[2-(methanesulfonamido)phenyl]ethyl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Name2-(furan-2-yl)-N-[1-[2-(methanesulfonamido)phenyl]ethyl]cyclopropane-1-carboxamide
PubChem CID86852835
Molecular FormulaC17H20N2O4S
Molecular Weight348.42 g/mol
Exact Mass348.11
IUPAC Name2-(furan-2-yl)-N-[1-[2-(methanesulfonamido)phenyl]ethyl]cyclopropane-1-carboxamide
SMILESCC(NC(=O)C1CC1c1ccco1)c1ccccc1NS(C)(=O)=O
InChIInChI=1S/C17H20N2O4S/c1-11(12-6-3-4-7-15(12)19-24(2,21)22)18-17(20)14-10-13(14)16-8-5-9-23-16/h3-9,11,13-14,19H,10H2,1-2H3,(H,18,20)
InChIKeyPQQSKDFMKHJLSG-UHFFFAOYSA-N
XLogP2.63
TPSA88.41 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.42
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-N-[1-[2-(methanesulfonamido)phenyl]ethyl]cyclopropane-1-carboxamide?
The IUPAC name of 2-(furan-2-yl)-N-[1-[2-(methanesulfonamido)phenyl]ethyl]cyclopropane-1-carboxamide (CID 86852835) is 2-(furan-2-yl)-N-[1-[2-(methanesulfonamido)phenyl]ethyl]cyclopropane-1-carboxamide.
What is the SMILES notation for 2-(furan-2-yl)-N-[1-[2-(methanesulfonamido)phenyl]ethyl]cyclopropane-1-carboxamide?
The canonical SMILES for 2-(furan-2-yl)-N-[1-[2-(methanesulfonamido)phenyl]ethyl]cyclopropane-1-carboxamide is CC(NC(=O)C1CC1c1ccco1)c1ccccc1NS(C)(=O)=O.
What is the InChIKey of 2-(furan-2-yl)-N-[1-[2-(methanesulfonamido)phenyl]ethyl]cyclopropane-1-carboxamide?
The InChIKey is PQQSKDFMKHJLSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4S/c1-11(12-6-3-4-7-15(12)19-24(2,21)22)18-17(20)14-10-13(14)16-8-5-9-23-16/h3-9,11,13-14,19H,10H2,1-2H3,(H,18,20).
What are the key properties of 2-(furan-2-yl)-N-[1-[2-(methanesulfonamido)phenyl]ethyl]cyclopropane-1-carboxamide?
2-(furan-2-yl)-N-[1-[2-(methanesulfonamido)phenyl]ethyl]cyclopropane-1-carboxamide has a molecular weight of 348.42 g/mol, XLogP of 2.63, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-N-[1-[2-(methanesulfonamido)phenyl]ethyl]cyclopropane-1-carboxamide is sourced from PubChem (CID 86852835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).