N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbutanamide

C17H26N2O5S — CID 46511351

IUPACN-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbutanamide
SMILESCCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)C(C)CC
InChIInChI=1S/C17H26N2O5S/c1-4-13(3)17(20)18-15-12-14(6-7-16(15)24-5-2)25(21,22)19-8-10-23-11-9-19/h6-7,12-13H,4-5,8-11H2,1-3H3,(H,18,20)
InChIKeyXJWDMVJZIZHBHD-UHFFFAOYSA-N
MW370.47 g/mol
LogP2.09
Rot. Bonds7

About N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbutanamide

N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbutanamide (PubChem CID 46511351) has the molecular formula C17H26N2O5S and a molecular weight of 370.47 g/mol. Its IUPAC name is N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbutanamide.

Molecular Properties

Compound NameN-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbutanamide
PubChem CID46511351
Molecular FormulaC17H26N2O5S
Molecular Weight370.47 g/mol
Exact Mass370.16
IUPAC NameN-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbutanamide
SMILESCCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)C(C)CC
InChIInChI=1S/C17H26N2O5S/c1-4-13(3)17(20)18-15-12-14(6-7-16(15)24-5-2)25(21,22)19-8-10-23-11-9-19/h6-7,12-13H,4-5,8-11H2,1-3H3,(H,18,20)
InChIKeyXJWDMVJZIZHBHD-UHFFFAOYSA-N
XLogP2.09
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.47
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbutanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-2-amino-N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)propanamide;hydrochloride
CID 119268074
(2R)-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylpentanamide
CID 8746910
N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-2-[4-(2-methylpropyl)phenyl]acetamide
CID 55395583
(2S)-N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-2-(6-methoxynaphthalen-2-yl)propanamide
CID 55937759
N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-2-(4-nitrophenyl)sulfanylpropanamide
CID 43024520
N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylpropanamide
CID 8746778
N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-2-(2-fluorophenyl)acetamide
CID 7719521
N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-2-(4-fluorophenyl)acetamide
CID 8502005
N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-2,6-difluorobenzamide
CID 26892844
2-(2,6-dichlorophenyl)-N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)acetamide
CID 4881777
5-chloro-N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)furan-2-carboxamide
CID 39802239
2-(2-chlorophenyl)sulfanyl-N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)acetamide
CID 27881487

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbutanamide?
The IUPAC name of N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbutanamide (CID 46511351) is N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbutanamide.
What is the SMILES notation for N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbutanamide?
The canonical SMILES for N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbutanamide is CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)C(C)CC.
What is the InChIKey of N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbutanamide?
The InChIKey is XJWDMVJZIZHBHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O5S/c1-4-13(3)17(20)18-15-12-14(6-7-16(15)24-5-2)25(21,22)19-8-10-23-11-9-19/h6-7,12-13H,4-5,8-11H2,1-3H3,(H,18,20).
What are the key properties of N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbutanamide?
N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbutanamide has a molecular weight of 370.47 g/mol, XLogP of 2.09, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbutanamide is sourced from PubChem (CID 46511351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).