3-[(4-methoxyphenyl)sulfonylamino]-N-nonylpropanamide

C19H32N2O4S — CID 43052252

IUPAC3-[(4-methoxyphenyl)sulfonylamino]-N-nonylpropanamide
SMILESCCCCCCCCCNC(=O)CCNS(=O)(=O)c1ccc(OC)cc1
InChIInChI=1S/C19H32N2O4S/c1-3-4-5-6-7-8-9-15-20-19(22)14-16-21-26(23,24)18-12-10-17(25-2)11-13-18/h10-13,21H,3-9,14-16H2,1-2H3,(H,20,22)
InChIKeyIZNHOOFLDNZGRS-UHFFFAOYSA-N
MW384.54 g/mol
LogP3.23
Rot. Bonds14

About 3-[(4-methoxyphenyl)sulfonylamino]-N-nonylpropanamide

3-[(4-methoxyphenyl)sulfonylamino]-N-nonylpropanamide (PubChem CID 43052252) has the molecular formula C19H32N2O4S and a molecular weight of 384.54 g/mol. Its IUPAC name is 3-[(4-methoxyphenyl)sulfonylamino]-N-nonylpropanamide.

Molecular Properties

Compound Name3-[(4-methoxyphenyl)sulfonylamino]-N-nonylpropanamide
PubChem CID43052252
Molecular FormulaC19H32N2O4S
Molecular Weight384.54 g/mol
Exact Mass384.21
IUPAC Name3-[(4-methoxyphenyl)sulfonylamino]-N-nonylpropanamide
SMILESCCCCCCCCCNC(=O)CCNS(=O)(=O)c1ccc(OC)cc1
InChIInChI=1S/C19H32N2O4S/c1-3-4-5-6-7-8-9-15-20-19(22)14-16-21-26(23,24)18-12-10-17(25-2)11-13-18/h10-13,21H,3-9,14-16H2,1-2H3,(H,20,22)
InChIKeyIZNHOOFLDNZGRS-UHFFFAOYSA-N
XLogP3.23
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds14
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.54
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(3-butoxypropyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 17192698
N-(2-methoxyethyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 5154817
N-[(4-methoxyphenyl)methyl]-3-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 17192613
3-[(4-methoxyphenyl)sulfonylamino]-N-methylpropanamide
CID 17192561
3-[(4-ethoxyphenyl)sulfonylamino]-N-propylpropanamide
CID 18104811
2-(4-butylphenyl)-N-[2-[(4-methoxyphenyl)sulfonylamino]ethyl]acetamide
CID 33433831
N-[2-(4-chlorophenyl)ethyl]-3-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 27646822
N-(3-aminopropyl)-3-[(4-ethoxyphenyl)sulfonylamino]propanamide
CID 119408093
N-[(4-chlorophenyl)methyl]-3-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 17192707
N-hexyl-2-(4-methoxyphenyl)acetamide
CID 3649296
N-[2-(4-methoxyphenyl)ethyl]-3-[(4-propan-2-ylphenyl)sulfonylamino]propanamide
CID 24538291
4-methoxy-N-[3-[(4-methoxyphenyl)sulfonylamino]propyl]benzenesulfonamide
CID 2164945

Frequently Asked Questions

What is the IUPAC name of 3-[(4-methoxyphenyl)sulfonylamino]-N-nonylpropanamide?
The IUPAC name of 3-[(4-methoxyphenyl)sulfonylamino]-N-nonylpropanamide (CID 43052252) is 3-[(4-methoxyphenyl)sulfonylamino]-N-nonylpropanamide.
What is the SMILES notation for 3-[(4-methoxyphenyl)sulfonylamino]-N-nonylpropanamide?
The canonical SMILES for 3-[(4-methoxyphenyl)sulfonylamino]-N-nonylpropanamide is CCCCCCCCCNC(=O)CCNS(=O)(=O)c1ccc(OC)cc1.
What is the InChIKey of 3-[(4-methoxyphenyl)sulfonylamino]-N-nonylpropanamide?
The InChIKey is IZNHOOFLDNZGRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N2O4S/c1-3-4-5-6-7-8-9-15-20-19(22)14-16-21-26(23,24)18-12-10-17(25-2)11-13-18/h10-13,21H,3-9,14-16H2,1-2H3,(H,20,22).
What are the key properties of 3-[(4-methoxyphenyl)sulfonylamino]-N-nonylpropanamide?
3-[(4-methoxyphenyl)sulfonylamino]-N-nonylpropanamide has a molecular weight of 384.54 g/mol, XLogP of 3.23, 14 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-methoxyphenyl)sulfonylamino]-N-nonylpropanamide is sourced from PubChem (CID 43052252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).