N-(1-amino-4-methylpentan-2-yl)-3-methoxythiophene-2-sulfonamide

C11H20N2O3S2 — CID 119983311

IUPACN-(1-amino-4-methylpentan-2-yl)-3-methoxythiophene-2-sulfonamide
SMILESCOc1ccsc1S(=O)(=O)NC(CN)CC(C)C
InChIInChI=1S/C11H20N2O3S2/c1-8(2)6-9(7-12)13-18(14,15)11-10(16-3)4-5-17-11/h4-5,8-9,13H,6-7,12H2,1-3H3
InChIKeyVZAPRNHZXONULE-UHFFFAOYSA-N
MW292.43 g/mol
LogP1.41
Rot. Bonds7

About N-(1-amino-4-methylpentan-2-yl)-3-methoxythiophene-2-sulfonamide

N-(1-amino-4-methylpentan-2-yl)-3-methoxythiophene-2-sulfonamide (PubChem CID 119983311) has the molecular formula C11H20N2O3S2 and a molecular weight of 292.43 g/mol. Its IUPAC name is N-(1-amino-4-methylpentan-2-yl)-3-methoxythiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(1-amino-4-methylpentan-2-yl)-3-methoxythiophene-2-sulfonamide
PubChem CID119983311
Molecular FormulaC11H20N2O3S2
Molecular Weight292.43 g/mol
Exact Mass292.09
IUPAC NameN-(1-amino-4-methylpentan-2-yl)-3-methoxythiophene-2-sulfonamide
SMILESCOc1ccsc1S(=O)(=O)NC(CN)CC(C)C
InChIInChI=1S/C11H20N2O3S2/c1-8(2)6-9(7-12)13-18(14,15)11-10(16-3)4-5-17-11/h4-5,8-9,13H,6-7,12H2,1-3H3
InChIKeyVZAPRNHZXONULE-UHFFFAOYSA-N
XLogP1.41
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.43
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-aminobutyl)-3-methoxythiophene-2-sulfonamide;hydrochloride
CID 119972633
2-[[(3-methoxythiophen-2-yl)sulfonylamino]methyl]-4-methylpentanoic acid
CID 120660505
N-(1-amino-4-methylpentan-2-yl)-5-chloro-2-methoxybenzenesulfonamide
CID 120710742
N-(1-amino-4-methylpentan-2-yl)-5-chloro-2-methoxybenzenesulfonamide;hydrochloride
CID 120710741
N-(1-amino-4-methylpentan-2-yl)-2,5-dichloro-4-methoxybenzenesulfonamide
CID 119983283
N-(1-amino-4-methylpentan-2-yl)-5-bromo-2,4-dimethoxybenzenesulfonamide
CID 119983487
N-(1-hydroxybut-3-yn-2-yl)-3-methoxythiophene-2-sulfonamide
CID 126821576
N-(1-amino-4-methylpentan-2-yl)-5-bromo-2-methoxy-4-methylbenzenesulfonamide
CID 119983120
N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]-3-methoxythiophene-2-sulfonamide;hydrochloride
CID 119976009
3-methoxy-N-[3-(methylamino)propyl]thiophene-2-sulfonamide
CID 119964955
N-(1-amino-4-methylpentan-2-yl)-4-bromobenzenesulfonamide
CID 63887954
N-(2-aminopentyl)-3-methoxythiophene-2-sulfonamide;hydrochloride
CID 86780765

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-4-methylpentan-2-yl)-3-methoxythiophene-2-sulfonamide?
The IUPAC name of N-(1-amino-4-methylpentan-2-yl)-3-methoxythiophene-2-sulfonamide (CID 119983311) is N-(1-amino-4-methylpentan-2-yl)-3-methoxythiophene-2-sulfonamide.
What is the SMILES notation for N-(1-amino-4-methylpentan-2-yl)-3-methoxythiophene-2-sulfonamide?
The canonical SMILES for N-(1-amino-4-methylpentan-2-yl)-3-methoxythiophene-2-sulfonamide is COc1ccsc1S(=O)(=O)NC(CN)CC(C)C.
What is the InChIKey of N-(1-amino-4-methylpentan-2-yl)-3-methoxythiophene-2-sulfonamide?
The InChIKey is VZAPRNHZXONULE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3S2/c1-8(2)6-9(7-12)13-18(14,15)11-10(16-3)4-5-17-11/h4-5,8-9,13H,6-7,12H2,1-3H3.
What are the key properties of N-(1-amino-4-methylpentan-2-yl)-3-methoxythiophene-2-sulfonamide?
N-(1-amino-4-methylpentan-2-yl)-3-methoxythiophene-2-sulfonamide has a molecular weight of 292.43 g/mol, XLogP of 1.41, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-4-methylpentan-2-yl)-3-methoxythiophene-2-sulfonamide is sourced from PubChem (CID 119983311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).