N-(3-aminopropyl)-N-methylmorpholine-4-sulfonamide

C8H19N3O3S — CID 28783227

IUPACN-(3-aminopropyl)-N-methylmorpholine-4-sulfonamide
SMILESCN(CCCN)S(=O)(=O)N1CCOCC1
InChIInChI=1S/C8H19N3O3S/c1-10(4-2-3-9)15(12,13)11-5-7-14-8-6-11/h2-9H2,1H3
InChIKeyFKGSNBMEHZQWGE-UHFFFAOYSA-N
MW237.32 g/mol
LogP-1.16
Rot. Bonds5

About N-(3-aminopropyl)-N-methylmorpholine-4-sulfonamide

N-(3-aminopropyl)-N-methylmorpholine-4-sulfonamide (PubChem CID 28783227) has the molecular formula C8H19N3O3S and a molecular weight of 237.32 g/mol. Its IUPAC name is N-(3-aminopropyl)-N-methylmorpholine-4-sulfonamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-N-methylmorpholine-4-sulfonamide
PubChem CID28783227
Molecular FormulaC8H19N3O3S
Molecular Weight237.32 g/mol
Exact Mass237.11
IUPAC NameN-(3-aminopropyl)-N-methylmorpholine-4-sulfonamide
SMILESCN(CCCN)S(=O)(=O)N1CCOCC1
InChIInChI=1S/C8H19N3O3S/c1-10(4-2-3-9)15(12,13)11-5-7-14-8-6-11/h2-9H2,1H3
InChIKeyFKGSNBMEHZQWGE-UHFFFAOYSA-N
XLogP-1.16
TPSA75.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.32
LogP ≤ 5-1.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 94179554
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CID 94179555
CID 94179556
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CID 113755172
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CID 114384138
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CID 114811190
CID 114811190
CID 114811196
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CID 224598
CID 224598

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-N-methylmorpholine-4-sulfonamide?
The IUPAC name of N-(3-aminopropyl)-N-methylmorpholine-4-sulfonamide (CID 28783227) is N-(3-aminopropyl)-N-methylmorpholine-4-sulfonamide.
What is the SMILES notation for N-(3-aminopropyl)-N-methylmorpholine-4-sulfonamide?
The canonical SMILES for N-(3-aminopropyl)-N-methylmorpholine-4-sulfonamide is CN(CCCN)S(=O)(=O)N1CCOCC1.
What is the InChIKey of N-(3-aminopropyl)-N-methylmorpholine-4-sulfonamide?
The InChIKey is FKGSNBMEHZQWGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N3O3S/c1-10(4-2-3-9)15(12,13)11-5-7-14-8-6-11/h2-9H2,1H3.
What are the key properties of N-(3-aminopropyl)-N-methylmorpholine-4-sulfonamide?
N-(3-aminopropyl)-N-methylmorpholine-4-sulfonamide has a molecular weight of 237.32 g/mol, XLogP of -1.16, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-N-methylmorpholine-4-sulfonamide is sourced from PubChem (CID 28783227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).