N-(furan-2-ylmethyl)-N-prop-2-enylpropane-2-sulfonamide

C11H17NO3S — CID 10490437

IUPACN-(furan-2-ylmethyl)-N-prop-2-enylpropane-2-sulfonamide
SMILESC=CCN(Cc1ccco1)S(=O)(=O)C(C)C
InChIInChI=1S/C11H17NO3S/c1-4-7-12(16(13,14)10(2)3)9-11-6-5-8-15-11/h4-6,8,10H,1,7,9H2,2-3H3
InChIKeyFZLWYQUXLHGVDW-UHFFFAOYSA-N
MW243.33 g/mol
LogP2.01
Rot. Bonds6

About N-(furan-2-ylmethyl)-N-prop-2-enylpropane-2-sulfonamide

N-(furan-2-ylmethyl)-N-prop-2-enylpropane-2-sulfonamide (PubChem CID 10490437) has the molecular formula C11H17NO3S and a molecular weight of 243.33 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-N-prop-2-enylpropane-2-sulfonamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-N-prop-2-enylpropane-2-sulfonamide
PubChem CID10490437
Molecular FormulaC11H17NO3S
Molecular Weight243.33 g/mol
Exact Mass243.09
IUPAC NameN-(furan-2-ylmethyl)-N-prop-2-enylpropane-2-sulfonamide
SMILESC=CCN(Cc1ccco1)S(=O)(=O)C(C)C
InChIInChI=1S/C11H17NO3S/c1-4-7-12(16(13,14)10(2)3)9-11-6-5-8-15-11/h4-6,8,10H,1,7,9H2,2-3H3
InChIKeyFZLWYQUXLHGVDW-UHFFFAOYSA-N
XLogP2.01
TPSA50.52 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.33
LogP ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-(furan-2-ylmethyl)-N-(2,2,2-trifluoroethyl)propane-2-sulfonamide
CID 64585549
2-[1-(furan-2-yl)propan-2-yl-prop-2-enylamino]acetic acid
CID 79285506
N-[(2-chlorophenyl)methyl]-N-(furan-2-ylmethyl)methanesulfonamide
CID 889054
N-(furan-2-ylmethyl)-N-(2,2,2-trifluoroethyl)ethanesulfonamide
CID 64585550
1-(furan-2-ylmethyl)-1-prop-2-enylthiourea
CID 172640364
2-[2-cyanoethyl(furan-2-ylmethyl)sulfamoyl]propanoic acid
CID 61458170
3-[ethylsulfonyl(furan-2-ylmethyl)amino]propanoic acid
CID 50894680
3-chloro-N-(furan-2-ylmethyl)-N,2-dimethylpropane-1-sulfonamide
CID 79580377
N-(furan-2-ylmethyl)-4-methyl-2-propan-2-yl-N-prop-2-enyl-1,3-thiazole-5-carboxamide
CID 50956140
3-chloro-N-ethyl-N-(furan-2-ylmethyl)propane-1-sulfonamide
CID 60958479
N-(furan-2-ylmethyl)-N-methyl-4-propan-2-ylbenzenesulfonamide
CID 51169518
4-amino-N-ethyl-N-(furan-2-ylmethyl)benzenesulfonamide
CID 61105124

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-N-prop-2-enylpropane-2-sulfonamide?
The IUPAC name of N-(furan-2-ylmethyl)-N-prop-2-enylpropane-2-sulfonamide (CID 10490437) is N-(furan-2-ylmethyl)-N-prop-2-enylpropane-2-sulfonamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-N-prop-2-enylpropane-2-sulfonamide?
The canonical SMILES for N-(furan-2-ylmethyl)-N-prop-2-enylpropane-2-sulfonamide is C=CCN(Cc1ccco1)S(=O)(=O)C(C)C.
What is the InChIKey of N-(furan-2-ylmethyl)-N-prop-2-enylpropane-2-sulfonamide?
The InChIKey is FZLWYQUXLHGVDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO3S/c1-4-7-12(16(13,14)10(2)3)9-11-6-5-8-15-11/h4-6,8,10H,1,7,9H2,2-3H3.
What are the key properties of N-(furan-2-ylmethyl)-N-prop-2-enylpropane-2-sulfonamide?
N-(furan-2-ylmethyl)-N-prop-2-enylpropane-2-sulfonamide has a molecular weight of 243.33 g/mol, XLogP of 2.01, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-N-prop-2-enylpropane-2-sulfonamide is sourced from PubChem (CID 10490437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).