4-amino-N-[1-(dimethylamino)propan-2-yl]-N-ethylthiophene-2-sulfonamide

C11H21N3O2S2 — CID 103187456

IUPAC4-amino-N-[1-(dimethylamino)propan-2-yl]-N-ethylthiophene-2-sulfonamide
SMILESCCN(C(C)CN(C)C)S(=O)(=O)c1cc(N)cs1
InChIInChI=1S/C11H21N3O2S2/c1-5-14(9(2)7-13(3)4)18(15,16)11-6-10(12)8-17-11/h6,8-9H,5,7,12H2,1-4H3
InChIKeySLJFIGZCYHVQFQ-UHFFFAOYSA-N
MW291.44 g/mol
LogP1.29
Rot. Bonds6

About 4-amino-N-[1-(dimethylamino)propan-2-yl]-N-ethylthiophene-2-sulfonamide

4-amino-N-[1-(dimethylamino)propan-2-yl]-N-ethylthiophene-2-sulfonamide (PubChem CID 103187456) has the molecular formula C11H21N3O2S2 and a molecular weight of 291.44 g/mol. Its IUPAC name is 4-amino-N-[1-(dimethylamino)propan-2-yl]-N-ethylthiophene-2-sulfonamide.

Molecular Properties

Compound Name4-amino-N-[1-(dimethylamino)propan-2-yl]-N-ethylthiophene-2-sulfonamide
PubChem CID103187456
Molecular FormulaC11H21N3O2S2
Molecular Weight291.44 g/mol
Exact Mass291.11
IUPAC Name4-amino-N-[1-(dimethylamino)propan-2-yl]-N-ethylthiophene-2-sulfonamide
SMILESCCN(C(C)CN(C)C)S(=O)(=O)c1cc(N)cs1
InChIInChI=1S/C11H21N3O2S2/c1-5-14(9(2)7-13(3)4)18(15,16)11-6-10(12)8-17-11/h6,8-9H,5,7,12H2,1-4H3
InChIKeySLJFIGZCYHVQFQ-UHFFFAOYSA-N
XLogP1.29
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.44
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-amino-N-ethyl-N-propan-2-ylthiophene-2-sulfonamide
CID 61299968
4-amino-N-methyl-N-(2-methylbutyl)thiophene-2-sulfonamide
CID 61300540
4-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]thiophene-2-sulfonamide
CID 61301534
4-amino-N-methyl-N-(1-methylsulfanylpropan-2-yl)thiophene-2-sulfonamide
CID 112656690
4-amino-N-benzyl-N-propan-2-ylthiophene-2-sulfonamide
CID 61300920
5-amino-N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-methylbenzenesulfonamide
CID 103187524
N-[1-(dimethylamino)propan-2-yl]-N-ethyl-5-(hydroxymethyl)thiophene-3-sulfonamide
CID 103192204
4-amino-N-methyl-N-(2-methylsulfonylethyl)thiophene-2-sulfonamide
CID 79850156
4-amino-N,N-dibutylthiophene-2-sulfonamide
CID 61301508
4-amino-N-[2-(dimethylamino)propyl]thiophene-2-sulfonamide
CID 61300006
4-amino-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)thiophene-2-sulfonamide
CID 61300173
3-amino-5-chloro-N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-fluorobenzenesulfonamide
CID 103187486

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[1-(dimethylamino)propan-2-yl]-N-ethylthiophene-2-sulfonamide?
The IUPAC name of 4-amino-N-[1-(dimethylamino)propan-2-yl]-N-ethylthiophene-2-sulfonamide (CID 103187456) is 4-amino-N-[1-(dimethylamino)propan-2-yl]-N-ethylthiophene-2-sulfonamide.
What is the SMILES notation for 4-amino-N-[1-(dimethylamino)propan-2-yl]-N-ethylthiophene-2-sulfonamide?
The canonical SMILES for 4-amino-N-[1-(dimethylamino)propan-2-yl]-N-ethylthiophene-2-sulfonamide is CCN(C(C)CN(C)C)S(=O)(=O)c1cc(N)cs1.
What is the InChIKey of 4-amino-N-[1-(dimethylamino)propan-2-yl]-N-ethylthiophene-2-sulfonamide?
The InChIKey is SLJFIGZCYHVQFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2S2/c1-5-14(9(2)7-13(3)4)18(15,16)11-6-10(12)8-17-11/h6,8-9H,5,7,12H2,1-4H3.
What are the key properties of 4-amino-N-[1-(dimethylamino)propan-2-yl]-N-ethylthiophene-2-sulfonamide?
4-amino-N-[1-(dimethylamino)propan-2-yl]-N-ethylthiophene-2-sulfonamide has a molecular weight of 291.44 g/mol, XLogP of 1.29, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[1-(dimethylamino)propan-2-yl]-N-ethylthiophene-2-sulfonamide is sourced from PubChem (CID 103187456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).