2-cyano-3-fluoro-N-[(1R)-1-(furan-2-yl)ethyl]-N-methylbenzenesulfonamide

Name: 2-cyano-3-fluoro-N-[(1R)-1-(furan-2-yl)ethyl]-N-methylbenzenesulfonamide — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₄H₁₃FN₂O₃S — CID 95781639

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC2-cyano-3-fluoro-N-[(1R)-1-(furan-2-yl)ethyl]-N-methylbenzenesulfonamide

SMILESC[C@H](c1ccco1)N(C)S(=O)(=O)c1cccc(F)c1C#N

InChIInChI=1S/C14H13FN2O3S/c1-10(13-6-4-8-20-13)17(2)21(18,19)14-7-3-5-12(15)11(14)9-16/h3-8,10H,1-2H3/t10-/m1/s1

InChIKeyPKGQFXOSQUQRJI-SNVBAGLBSA-N

MW308.33 g/mol

LogP2.67

Rot. Bonds4

About 2-cyano-3-fluoro-N-[(1R)-1-(furan-2-yl)ethyl]-N-methylbenzenesulfonamide

2-cyano-3-fluoro-N-[(1R)-1-(furan-2-yl)ethyl]-N-methylbenzenesulfonamide (PubChem CID 95781639) has the molecular formula C₁₄H₁₃FN₂O₃S and a molecular weight of 308.33 g/mol. Its IUPAC name is 2-cyano-3-fluoro-N-[(1R)-1-(furan-2-yl)ethyl]-N-methylbenzenesulfonamide.

Molecular Properties

Compound Name	2-cyano-3-fluoro-N-[(1R)-1-(furan-2-yl)ethyl]-N-methylbenzenesulfonamide
PubChem CID	95781639
Molecular Formula	C₁₄H₁₃FN₂O₃S
Molecular Weight	308.33 g/mol
Exact Mass	308.06
IUPAC Name	2-cyano-3-fluoro-N-[(1R)-1-(furan-2-yl)ethyl]-N-methylbenzenesulfonamide
SMILES	C[C@H](c1ccco1)N(C)S(=O)(=O)c1cccc(F)c1C#N
InChI	InChI=1S/C14H13FN2O3S/c1-10(13-6-4-8-20-13)17(2)21(18,19)14-7-3-5-12(15)11(14)9-16/h3-8,10H,1-2H3/t10-/m1/s1
InChIKey	PKGQFXOSQUQRJI-SNVBAGLBSA-N
XLogP	2.67
TPSA	74.31 Å²
H-Bond Donors
H-Bond Acceptors	4
Rotatable Bonds	4
Heavy Atoms	21
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	308.33
LogP ≤ 5	2.67
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 2-cyano-3-fluoro-N-[(1R)-1-(furan-2-yl)ethyl]-N-methylbenzenesulfonamide?

The IUPAC name of 2-cyano-3-fluoro-N-[(1R)-1-(furan-2-yl)ethyl]-N-methylbenzenesulfonamide (CID 95781639) is 2-cyano-3-fluoro-N-[(1R)-1-(furan-2-yl)ethyl]-N-methylbenzenesulfonamide.

What is the SMILES notation for 2-cyano-3-fluoro-N-[(1R)-1-(furan-2-yl)ethyl]-N-methylbenzenesulfonamide?

The canonical SMILES for 2-cyano-3-fluoro-N-[(1R)-1-(furan-2-yl)ethyl]-N-methylbenzenesulfonamide is C[C@H](c1ccco1)N(C)S(=O)(=O)c1cccc(F)c1C#N.

What is the InChIKey of 2-cyano-3-fluoro-N-[(1R)-1-(furan-2-yl)ethyl]-N-methylbenzenesulfonamide?

The InChIKey is PKGQFXOSQUQRJI-SNVBAGLBSA-N. The full InChI is InChI=1S/C14H13FN2O3S/c1-10(13-6-4-8-20-13)17(2)21(18,19)14-7-3-5-12(15)11(14)9-16/h3-8,10H,1-2H3/t10-/m1/s1.

What are the key properties of 2-cyano-3-fluoro-N-[(1R)-1-(furan-2-yl)ethyl]-N-methylbenzenesulfonamide?

2-cyano-3-fluoro-N-[(1R)-1-(furan-2-yl)ethyl]-N-methylbenzenesulfonamide has a molecular weight of 308.33 g/mol, XLogP of 2.67, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 2-cyano-3-fluoro-N-[(1R)-1-(furan-2-yl)ethyl]-N-methylbenzenesulfonamide is sourced from PubChem (CID 95781639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 95781639 — identifiers, structure, computed properties (public domain)

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