N-ethyl-2-methoxy-N-(2-methoxyethyl)-5-(1H-pyrazol-5-yl)benzenesulfonamide

C15H21N3O4S — CID 171909595

IUPACN-ethyl-2-methoxy-N-(2-methoxyethyl)-5-(1H-pyrazol-5-yl)benzenesulfonamide
SMILESCCN(CCOC)S(=O)(=O)c1cc(-c2ccn[nH]2)ccc1OC
InChIInChI=1S/C15H21N3O4S/c1-4-18(9-10-21-2)23(19,20)15-11-12(5-6-14(15)22-3)13-7-8-16-17-13/h5-8,11H,4,9-10H2,1-3H3,(H,16,17)
InChIKeyLESXTNHXTUTISZ-UHFFFAOYSA-N
MW339.42 g/mol
LogP1.74
Rot. Bonds8

About N-ethyl-2-methoxy-N-(2-methoxyethyl)-5-(1H-pyrazol-5-yl)benzenesulfonamide

N-ethyl-2-methoxy-N-(2-methoxyethyl)-5-(1H-pyrazol-5-yl)benzenesulfonamide (PubChem CID 171909595) has the molecular formula C15H21N3O4S and a molecular weight of 339.42 g/mol. Its IUPAC name is N-ethyl-2-methoxy-N-(2-methoxyethyl)-5-(1H-pyrazol-5-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-ethyl-2-methoxy-N-(2-methoxyethyl)-5-(1H-pyrazol-5-yl)benzenesulfonamide
PubChem CID171909595
Molecular FormulaC15H21N3O4S
Molecular Weight339.42 g/mol
Exact Mass339.13
IUPAC NameN-ethyl-2-methoxy-N-(2-methoxyethyl)-5-(1H-pyrazol-5-yl)benzenesulfonamide
SMILESCCN(CCOC)S(=O)(=O)c1cc(-c2ccn[nH]2)ccc1OC
InChIInChI=1S/C15H21N3O4S/c1-4-18(9-10-21-2)23(19,20)15-11-12(5-6-14(15)22-3)13-7-8-16-17-13/h5-8,11H,4,9-10H2,1-3H3,(H,16,17)
InChIKeyLESXTNHXTUTISZ-UHFFFAOYSA-N
XLogP1.74
TPSA84.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.42
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-amino-N-ethyl-2-methoxy-N-(2-methoxyethyl)benzenesulfonamide
CID 61444696
N-(2-methoxyethyl)-N-(3-methoxypropyl)-1H-pyrazole-5-sulfonamide
CID 102692312
5-bromo-N-[2-(diethylamino)ethyl]-N-ethyl-2-methoxybenzenesulfonamide
CID 3751126
2-chloro-N-ethyl-N-(2-methoxyethyl)pyridine-3-sulfonamide
CID 54948785
5-(aminomethyl)-2-methoxy-N-(2-methoxyethyl)-N-prop-2-enylbenzenesulfonamide
CID 103340767
6-amino-N-ethyl-N-(2-methoxyethyl)-1H-indole-3-sulfonamide
CID 66000340
2-amino-4-bromo-N-ethyl-N-(2-methoxyethyl)benzenesulfonamide
CID 61444697
5-(4-fluoro-3-methoxyphenyl)-1H-pyrazole
CID 70662601
5-(1-acetyl-2-methyl-3,4-dihydro-2H-quinoxalin-6-yl)-N,N-diethyl-2-methoxybenzenesulfonamide
CID 123852801
5-bromo-2-methoxy-N,N-dipropylbenzenesulfonamide
CID 7749525
1-N-ethyl-2-fluoro-1-N-(2-methoxyethyl)benzene-1,4-disulfonamide
CID 61384433
2-cyano-N-ethyl-N-(2-methoxyethyl)benzenesulfonamide
CID 61384582

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methoxy-N-(2-methoxyethyl)-5-(1H-pyrazol-5-yl)benzenesulfonamide?
The IUPAC name of N-ethyl-2-methoxy-N-(2-methoxyethyl)-5-(1H-pyrazol-5-yl)benzenesulfonamide (CID 171909595) is N-ethyl-2-methoxy-N-(2-methoxyethyl)-5-(1H-pyrazol-5-yl)benzenesulfonamide.
What is the SMILES notation for N-ethyl-2-methoxy-N-(2-methoxyethyl)-5-(1H-pyrazol-5-yl)benzenesulfonamide?
The canonical SMILES for N-ethyl-2-methoxy-N-(2-methoxyethyl)-5-(1H-pyrazol-5-yl)benzenesulfonamide is CCN(CCOC)S(=O)(=O)c1cc(-c2ccn[nH]2)ccc1OC.
What is the InChIKey of N-ethyl-2-methoxy-N-(2-methoxyethyl)-5-(1H-pyrazol-5-yl)benzenesulfonamide?
The InChIKey is LESXTNHXTUTISZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O4S/c1-4-18(9-10-21-2)23(19,20)15-11-12(5-6-14(15)22-3)13-7-8-16-17-13/h5-8,11H,4,9-10H2,1-3H3,(H,16,17).
What are the key properties of N-ethyl-2-methoxy-N-(2-methoxyethyl)-5-(1H-pyrazol-5-yl)benzenesulfonamide?
N-ethyl-2-methoxy-N-(2-methoxyethyl)-5-(1H-pyrazol-5-yl)benzenesulfonamide has a molecular weight of 339.42 g/mol, XLogP of 1.74, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methoxy-N-(2-methoxyethyl)-5-(1H-pyrazol-5-yl)benzenesulfonamide is sourced from PubChem (CID 171909595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).