4-(2-chlorophenyl)-N-(2-morpholin-4-ylsulfonylethyl)butanamide

C16H23ClN2O4S — CID 110626706

IUPAC4-(2-chlorophenyl)-N-(2-morpholin-4-ylsulfonylethyl)butanamide
SMILESO=C(CCCc1ccccc1Cl)NCCS(=O)(=O)N1CCOCC1
InChIInChI=1S/C16H23ClN2O4S/c17-15-6-2-1-4-14(15)5-3-7-16(20)18-8-13-24(21,22)19-9-11-23-12-10-19/h1-2,4,6H,3,5,7-13H2,(H,18,20)
InChIKeyAVHHGXWXLMDBLH-UHFFFAOYSA-N
MW374.89 g/mol
LogP1.44
Rot. Bonds8

About 4-(2-chlorophenyl)-N-(2-morpholin-4-ylsulfonylethyl)butanamide

4-(2-chlorophenyl)-N-(2-morpholin-4-ylsulfonylethyl)butanamide (PubChem CID 110626706) has the molecular formula C16H23ClN2O4S and a molecular weight of 374.89 g/mol. Its IUPAC name is 4-(2-chlorophenyl)-N-(2-morpholin-4-ylsulfonylethyl)butanamide.

Molecular Properties

Compound Name4-(2-chlorophenyl)-N-(2-morpholin-4-ylsulfonylethyl)butanamide
PubChem CID110626706
Molecular FormulaC16H23ClN2O4S
Molecular Weight374.89 g/mol
Exact Mass374.11
IUPAC Name4-(2-chlorophenyl)-N-(2-morpholin-4-ylsulfonylethyl)butanamide
SMILESO=C(CCCc1ccccc1Cl)NCCS(=O)(=O)N1CCOCC1
InChIInChI=1S/C16H23ClN2O4S/c17-15-6-2-1-4-14(15)5-3-7-16(20)18-8-13-24(21,22)19-9-11-23-12-10-19/h1-2,4,6H,3,5,7-13H2,(H,18,20)
InChIKeyAVHHGXWXLMDBLH-UHFFFAOYSA-N
XLogP1.44
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.89
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-methylphenyl)-N-(2-morpholin-4-ylsulfonylethyl)butanamide
CID 110626702
N-(2-morpholin-4-ylsulfonylethyl)-5-oxo-5-phenylpentanamide
CID 110354154
2-[(2-chlorophenyl)methyl]-1-ethyl-3-(2-morpholin-4-ylsulfonylethyl)guanidine
CID 111175737
N-[4-(2-chlorophenyl)butyl]-3-methylsulfonylpropanamide
CID 110607257
N-(4-acetamidobutyl)-4-(2-chlorophenyl)butanamide
CID 110609861
N-[2-(azepan-1-ylsulfonyl)ethyl]-3-phenylpropanamide
CID 110346023
N-[3-(2-chlorophenyl)propyl]-2-[N-methylsulfonyl-4-(morpholine-4-carbonyl)anilino]acetamide
CID 30277293
2-(2-chlorophenyl)-N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]acetamide
CID 25285260
2-(2-chlorophenyl)-N-(2-morpholin-4-ylethyl)acetamide
CID 17217479
4-(2-chlorophenyl)-N-(4-methoxybutyl)butanamide
CID 110610239
3-[(1,1-dioxo-1,2-benzothiazol-3-ylidene)amino]-N-(2-morpholin-4-ylsulfonylethyl)propanamide
CID 135999661
2,6-dichloro-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide
CID 112803399

Frequently Asked Questions

What is the IUPAC name of 4-(2-chlorophenyl)-N-(2-morpholin-4-ylsulfonylethyl)butanamide?
The IUPAC name of 4-(2-chlorophenyl)-N-(2-morpholin-4-ylsulfonylethyl)butanamide (CID 110626706) is 4-(2-chlorophenyl)-N-(2-morpholin-4-ylsulfonylethyl)butanamide.
What is the SMILES notation for 4-(2-chlorophenyl)-N-(2-morpholin-4-ylsulfonylethyl)butanamide?
The canonical SMILES for 4-(2-chlorophenyl)-N-(2-morpholin-4-ylsulfonylethyl)butanamide is O=C(CCCc1ccccc1Cl)NCCS(=O)(=O)N1CCOCC1.
What is the InChIKey of 4-(2-chlorophenyl)-N-(2-morpholin-4-ylsulfonylethyl)butanamide?
The InChIKey is AVHHGXWXLMDBLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23ClN2O4S/c17-15-6-2-1-4-14(15)5-3-7-16(20)18-8-13-24(21,22)19-9-11-23-12-10-19/h1-2,4,6H,3,5,7-13H2,(H,18,20).
What are the key properties of 4-(2-chlorophenyl)-N-(2-morpholin-4-ylsulfonylethyl)butanamide?
4-(2-chlorophenyl)-N-(2-morpholin-4-ylsulfonylethyl)butanamide has a molecular weight of 374.89 g/mol, XLogP of 1.44, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-chlorophenyl)-N-(2-morpholin-4-ylsulfonylethyl)butanamide is sourced from PubChem (CID 110626706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).