2-[ethyl-[1-(3-methoxyphenyl)ethyl]amino]-N-(4-sulfamoylphenyl)acetamide

C19H25N3O4S — CID 55700187

IUPAC2-[ethyl-[1-(3-methoxyphenyl)ethyl]amino]-N-(4-sulfamoylphenyl)acetamide
SMILESCCN(CC(=O)Nc1ccc(S(N)(=O)=O)cc1)C(C)c1cccc(OC)c1
InChIInChI=1S/C19H25N3O4S/c1-4-22(14(2)15-6-5-7-17(12-15)26-3)13-19(23)21-16-8-10-18(11-9-16)27(20,24)25/h5-12,14H,4,13H2,1-3H3,(H,21,23)(H2,20,24,25)
InChIKeyPVXGMAYXCSMQEY-UHFFFAOYSA-N
MW391.49 g/mol
LogP2.36
Rot. Bonds8

About 2-[ethyl-[1-(3-methoxyphenyl)ethyl]amino]-N-(4-sulfamoylphenyl)acetamide

2-[ethyl-[1-(3-methoxyphenyl)ethyl]amino]-N-(4-sulfamoylphenyl)acetamide (PubChem CID 55700187) has the molecular formula C19H25N3O4S and a molecular weight of 391.49 g/mol. Its IUPAC name is 2-[ethyl-[1-(3-methoxyphenyl)ethyl]amino]-N-(4-sulfamoylphenyl)acetamide.

Molecular Properties

Compound Name2-[ethyl-[1-(3-methoxyphenyl)ethyl]amino]-N-(4-sulfamoylphenyl)acetamide
PubChem CID55700187
Molecular FormulaC19H25N3O4S
Molecular Weight391.49 g/mol
Exact Mass391.16
IUPAC Name2-[ethyl-[1-(3-methoxyphenyl)ethyl]amino]-N-(4-sulfamoylphenyl)acetamide
SMILESCCN(CC(=O)Nc1ccc(S(N)(=O)=O)cc1)C(C)c1cccc(OC)c1
InChIInChI=1S/C19H25N3O4S/c1-4-22(14(2)15-6-5-7-17(12-15)26-3)13-19(23)21-16-8-10-18(11-9-16)27(20,24)25/h5-12,14H,4,13H2,1-3H3,(H,21,23)(H2,20,24,25)
InChIKeyPVXGMAYXCSMQEY-UHFFFAOYSA-N
XLogP2.36
TPSA101.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.49
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-2-(4-sulfamoylphenyl)acetamide
CID 56538689
2-(3-methoxyphenoxy)-N-(4-sulfamoylphenyl)acetamide
CID 19204089
N-benzyl-2-[ethyl-[1-(3-methoxyphenyl)ethyl]amino]acetamide
CID 75878483
2-[[2-[ethyl-[1-(3-methoxyphenyl)ethyl]amino]acetyl]amino]-N-(2,4,6-trimethylphenyl)acetamide
CID 55702850
2-[ethyl-[1-(3-methoxyphenyl)ethyl]amino]-N-[(2-fluorophenyl)methyl]acetamide
CID 75878457
1-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-3-(4-sulfamoylphenyl)urea
CID 24650615
N-(2,6-dichlorophenyl)-3-[ethyl-[1-(3-methoxyphenyl)ethyl]amino]propanamide
CID 56524555
ethyl-[2-(4-methoxyanilino)-2-oxoethyl]-[2-oxo-2-(4-sulfamoylanilino)ethyl]azanium
CID 2442436
2-(3-methoxyphenyl)-N-(4-propan-2-ylsulfonylphenyl)acetamide
CID 110778748
2-[ethyl(methylsulfonyl)amino]-N-(3-methoxyphenyl)acetamide
CID 47121758
(2R)-2-[ethyl-[2-(4-methoxyanilino)-2-oxoethyl]amino]-N-naphthalen-2-ylpropanamide
CID 9027057
4-amino-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]pentanamide
CID 120559009

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-[1-(3-methoxyphenyl)ethyl]amino]-N-(4-sulfamoylphenyl)acetamide?
The IUPAC name of 2-[ethyl-[1-(3-methoxyphenyl)ethyl]amino]-N-(4-sulfamoylphenyl)acetamide (CID 55700187) is 2-[ethyl-[1-(3-methoxyphenyl)ethyl]amino]-N-(4-sulfamoylphenyl)acetamide.
What is the SMILES notation for 2-[ethyl-[1-(3-methoxyphenyl)ethyl]amino]-N-(4-sulfamoylphenyl)acetamide?
The canonical SMILES for 2-[ethyl-[1-(3-methoxyphenyl)ethyl]amino]-N-(4-sulfamoylphenyl)acetamide is CCN(CC(=O)Nc1ccc(S(N)(=O)=O)cc1)C(C)c1cccc(OC)c1.
What is the InChIKey of 2-[ethyl-[1-(3-methoxyphenyl)ethyl]amino]-N-(4-sulfamoylphenyl)acetamide?
The InChIKey is PVXGMAYXCSMQEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O4S/c1-4-22(14(2)15-6-5-7-17(12-15)26-3)13-19(23)21-16-8-10-18(11-9-16)27(20,24)25/h5-12,14H,4,13H2,1-3H3,(H,21,23)(H2,20,24,25).
What are the key properties of 2-[ethyl-[1-(3-methoxyphenyl)ethyl]amino]-N-(4-sulfamoylphenyl)acetamide?
2-[ethyl-[1-(3-methoxyphenyl)ethyl]amino]-N-(4-sulfamoylphenyl)acetamide has a molecular weight of 391.49 g/mol, XLogP of 2.36, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-[1-(3-methoxyphenyl)ethyl]amino]-N-(4-sulfamoylphenyl)acetamide is sourced from PubChem (CID 55700187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).