N-(3-ethyl-2-morpholin-4-ylpentyl)butane-1-sulfonamide

C15H32N2O3S — CID 60568329

IUPACN-(3-ethyl-2-morpholin-4-ylpentyl)butane-1-sulfonamide
SMILESCCCCS(=O)(=O)NCC(C(CC)CC)N1CCOCC1
InChIInChI=1S/C15H32N2O3S/c1-4-7-12-21(18,19)16-13-15(14(5-2)6-3)17-8-10-20-11-9-17/h14-16H,4-13H2,1-3H3
InChIKeyPSDVNAMTYBIRFI-UHFFFAOYSA-N
MW320.50 g/mol
LogP1.84
Rot. Bonds10

About N-(3-ethyl-2-morpholin-4-ylpentyl)butane-1-sulfonamide

N-(3-ethyl-2-morpholin-4-ylpentyl)butane-1-sulfonamide (PubChem CID 60568329) has the molecular formula C15H32N2O3S and a molecular weight of 320.50 g/mol. Its IUPAC name is N-(3-ethyl-2-morpholin-4-ylpentyl)butane-1-sulfonamide.

Molecular Properties

Compound NameN-(3-ethyl-2-morpholin-4-ylpentyl)butane-1-sulfonamide
PubChem CID60568329
Molecular FormulaC15H32N2O3S
Molecular Weight320.50 g/mol
Exact Mass320.21
IUPAC NameN-(3-ethyl-2-morpholin-4-ylpentyl)butane-1-sulfonamide
SMILESCCCCS(=O)(=O)NCC(C(CC)CC)N1CCOCC1
InChIInChI=1S/C15H32N2O3S/c1-4-7-12-21(18,19)16-13-15(14(5-2)6-3)17-8-10-20-11-9-17/h14-16H,4-13H2,1-3H3
InChIKeyPSDVNAMTYBIRFI-UHFFFAOYSA-N
XLogP1.84
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.50
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-ethyl-2-morpholin-4-ylpentyl)butane-1-sulfonamide?
The IUPAC name of N-(3-ethyl-2-morpholin-4-ylpentyl)butane-1-sulfonamide (CID 60568329) is N-(3-ethyl-2-morpholin-4-ylpentyl)butane-1-sulfonamide.
What is the SMILES notation for N-(3-ethyl-2-morpholin-4-ylpentyl)butane-1-sulfonamide?
The canonical SMILES for N-(3-ethyl-2-morpholin-4-ylpentyl)butane-1-sulfonamide is CCCCS(=O)(=O)NCC(C(CC)CC)N1CCOCC1.
What is the InChIKey of N-(3-ethyl-2-morpholin-4-ylpentyl)butane-1-sulfonamide?
The InChIKey is PSDVNAMTYBIRFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O3S/c1-4-7-12-21(18,19)16-13-15(14(5-2)6-3)17-8-10-20-11-9-17/h14-16H,4-13H2,1-3H3.
What are the key properties of N-(3-ethyl-2-morpholin-4-ylpentyl)butane-1-sulfonamide?
N-(3-ethyl-2-morpholin-4-ylpentyl)butane-1-sulfonamide has a molecular weight of 320.50 g/mol, XLogP of 1.84, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethyl-2-morpholin-4-ylpentyl)butane-1-sulfonamide is sourced from PubChem (CID 60568329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).