N-[3-[(5,5-dimethyloxolan-2-yl)methylamino]propyl]methanesulfonamide

C11H24N2O3S — CID 114175166

IUPACN-[3-[(5,5-dimethyloxolan-2-yl)methylamino]propyl]methanesulfonamide
SMILESCC1(C)CCC(CNCCCNS(C)(=O)=O)O1
InChIInChI=1S/C11H24N2O3S/c1-11(2)6-5-10(16-11)9-12-7-4-8-13-17(3,14)15/h10,12-13H,4-9H2,1-3H3
InChIKeyMZMAIPSBELCRTA-UHFFFAOYSA-N
MW264.39 g/mol
LogP0.47
Rot. Bonds7

About N-[3-[(5,5-dimethyloxolan-2-yl)methylamino]propyl]methanesulfonamide

N-[3-[(5,5-dimethyloxolan-2-yl)methylamino]propyl]methanesulfonamide (PubChem CID 114175166) has the molecular formula C11H24N2O3S and a molecular weight of 264.39 g/mol. Its IUPAC name is N-[3-[(5,5-dimethyloxolan-2-yl)methylamino]propyl]methanesulfonamide.

Molecular Properties

Compound NameN-[3-[(5,5-dimethyloxolan-2-yl)methylamino]propyl]methanesulfonamide
PubChem CID114175166
Molecular FormulaC11H24N2O3S
Molecular Weight264.39 g/mol
Exact Mass264.15
IUPAC NameN-[3-[(5,5-dimethyloxolan-2-yl)methylamino]propyl]methanesulfonamide
SMILESCC1(C)CCC(CNCCCNS(C)(=O)=O)O1
InChIInChI=1S/C11H24N2O3S/c1-11(2)6-5-10(16-11)9-12-7-4-8-13-17(3,14)15/h10,12-13H,4-9H2,1-3H3
InChIKeyMZMAIPSBELCRTA-UHFFFAOYSA-N
XLogP0.47
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-[3-[(5,5-dimethyloxolan-2-yl)methylamino]propyl]methanesulfonamide 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

N'-[(5,5-dimethyloxolan-2-yl)methyl]ethane-1,2-diamine
CID 116521389
N-[[(2S)-6,6-dimethyloxan-2-yl]methyl]methanesulfonamide
CID 159631931
N-[3-(1,3-dioxan-4-ylmethylamino)propyl]methanesulfonamide
CID 106336749
1-(5,5-dimethyloxolan-2-yl)-N-[(4-methylsulfonylphenyl)methyl]methanamine
CID 116521375
N-[3-(2,3-dihydro-1-benzofuran-2-ylmethylamino)propyl]methanesulfonamide
CID 106336807
1-(5,5-dimethyloxolan-2-yl)-N-[(4-methyloxan-4-yl)methyl]methanamine
CID 104954515
N-[(5,5-dimethyloxolan-2-yl)methyl]-2-phenylethanamine
CID 116521126
N-[(5,5-dimethyloxolan-2-yl)methyl]-2-(triazol-1-yl)ethanamine
CID 116521666
N-[(5,5-dimethyloxolan-2-yl)methyl]-2-(2-methylphenyl)ethanamine
CID 116521558
N-cyclopropyl-2-[(5,5-dimethyloxolan-2-yl)methylamino]acetamide
CID 116521228
N-[(5,5-dimethyloxolan-2-yl)methyl]-2-methylpropan-2-amine
CID 116521163
N-[(5,5-dimethyloxolan-2-yl)methyl]-1-ethylcyclobutan-1-amine
CID 116521711

Frequently Asked Questions

What is the IUPAC name of N-[3-[(5,5-dimethyloxolan-2-yl)methylamino]propyl]methanesulfonamide?
The IUPAC name of N-[3-[(5,5-dimethyloxolan-2-yl)methylamino]propyl]methanesulfonamide (CID 114175166) is N-[3-[(5,5-dimethyloxolan-2-yl)methylamino]propyl]methanesulfonamide.
What is the SMILES notation for N-[3-[(5,5-dimethyloxolan-2-yl)methylamino]propyl]methanesulfonamide?
The canonical SMILES for N-[3-[(5,5-dimethyloxolan-2-yl)methylamino]propyl]methanesulfonamide is CC1(C)CCC(CNCCCNS(C)(=O)=O)O1.
What is the InChIKey of N-[3-[(5,5-dimethyloxolan-2-yl)methylamino]propyl]methanesulfonamide?
The InChIKey is MZMAIPSBELCRTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3S/c1-11(2)6-5-10(16-11)9-12-7-4-8-13-17(3,14)15/h10,12-13H,4-9H2,1-3H3.
What are the key properties of N-[3-[(5,5-dimethyloxolan-2-yl)methylamino]propyl]methanesulfonamide?
N-[3-[(5,5-dimethyloxolan-2-yl)methylamino]propyl]methanesulfonamide has a molecular weight of 264.39 g/mol, XLogP of 0.47, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(5,5-dimethyloxolan-2-yl)methylamino]propyl]methanesulfonamide is sourced from PubChem (CID 114175166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).