4-amino-N-methyl-N-[(2-methylfuran-3-yl)methyl]thiophene-2-sulfonamide

C11H14N2O3S2 — CID 61426476

IUPAC4-amino-N-methyl-N-[(2-methylfuran-3-yl)methyl]thiophene-2-sulfonamide
SMILESCc1occc1CN(C)S(=O)(=O)c1cc(N)cs1
InChIInChI=1S/C11H14N2O3S2/c1-8-9(3-4-16-8)6-13(2)18(14,15)11-5-10(12)7-17-11/h3-5,7H,6,12H2,1-2H3
InChIKeyQXVZTZZXHQACND-UHFFFAOYSA-N
MW286.38 g/mol
LogP2.05
Rot. Bonds4

About 4-amino-N-methyl-N-[(2-methylfuran-3-yl)methyl]thiophene-2-sulfonamide

4-amino-N-methyl-N-[(2-methylfuran-3-yl)methyl]thiophene-2-sulfonamide (PubChem CID 61426476) has the molecular formula C11H14N2O3S2 and a molecular weight of 286.38 g/mol. Its IUPAC name is 4-amino-N-methyl-N-[(2-methylfuran-3-yl)methyl]thiophene-2-sulfonamide.

Molecular Properties

Compound Name4-amino-N-methyl-N-[(2-methylfuran-3-yl)methyl]thiophene-2-sulfonamide
PubChem CID61426476
Molecular FormulaC11H14N2O3S2
Molecular Weight286.38 g/mol
Exact Mass286.04
IUPAC Name4-amino-N-methyl-N-[(2-methylfuran-3-yl)methyl]thiophene-2-sulfonamide
SMILESCc1occc1CN(C)S(=O)(=O)c1cc(N)cs1
InChIInChI=1S/C11H14N2O3S2/c1-8-9(3-4-16-8)6-13(2)18(14,15)11-5-10(12)7-17-11/h3-5,7H,6,12H2,1-2H3
InChIKeyQXVZTZZXHQACND-UHFFFAOYSA-N
XLogP2.05
TPSA76.54 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-bromo-N,4-dimethyl-N-[(2-methylfuran-3-yl)methyl]thiophene-2-sulfonamide
CID 79931229
5-amino-N,2,3-trimethyl-N-[(2-methylfuran-3-yl)methyl]benzenesulfonamide
CID 61426713
4-amino-N,2-dimethyl-N-[(2-methylfuran-3-yl)methyl]benzenesulfonamide
CID 61426919
4-amino-N-[(4-ethylphenyl)methyl]-N-methylthiophene-2-sulfonamide
CID 61299784
3-amino-4-ethyl-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzenesulfonamide
CID 61426284
4-amino-N-methyl-N-(2-methylsulfonylethyl)thiophene-2-sulfonamide
CID 79850156
5-amino-3-chloro-2-fluoro-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzenesulfonamide
CID 61426187
4-amino-3-methoxy-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzenesulfonamide
CID 81441145
4-amino-N-[(5-bromothiophen-3-yl)methyl]-N-methylthiophene-2-sulfonamide
CID 54982582
3-amino-2,4-difluoro-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzenesulfonamide
CID 107343380
2-amino-5-bromo-4-fluoro-N-methyl-N-[(2-methylfuran-3-yl)methyl]benzenesulfonamide
CID 106491612
2-chloro-N-methyl-N-[(2-methylfuran-3-yl)methyl]ethanesulfonamide
CID 107651758

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-methyl-N-[(2-methylfuran-3-yl)methyl]thiophene-2-sulfonamide?
The IUPAC name of 4-amino-N-methyl-N-[(2-methylfuran-3-yl)methyl]thiophene-2-sulfonamide (CID 61426476) is 4-amino-N-methyl-N-[(2-methylfuran-3-yl)methyl]thiophene-2-sulfonamide.
What is the SMILES notation for 4-amino-N-methyl-N-[(2-methylfuran-3-yl)methyl]thiophene-2-sulfonamide?
The canonical SMILES for 4-amino-N-methyl-N-[(2-methylfuran-3-yl)methyl]thiophene-2-sulfonamide is Cc1occc1CN(C)S(=O)(=O)c1cc(N)cs1.
What is the InChIKey of 4-amino-N-methyl-N-[(2-methylfuran-3-yl)methyl]thiophene-2-sulfonamide?
The InChIKey is QXVZTZZXHQACND-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O3S2/c1-8-9(3-4-16-8)6-13(2)18(14,15)11-5-10(12)7-17-11/h3-5,7H,6,12H2,1-2H3.
What are the key properties of 4-amino-N-methyl-N-[(2-methylfuran-3-yl)methyl]thiophene-2-sulfonamide?
4-amino-N-methyl-N-[(2-methylfuran-3-yl)methyl]thiophene-2-sulfonamide has a molecular weight of 286.38 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-methyl-N-[(2-methylfuran-3-yl)methyl]thiophene-2-sulfonamide is sourced from PubChem (CID 61426476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).