N-[2-methyl-1-(oxolan-3-ylmethylamino)propan-2-yl]methanesulfonamide

C10H22N2O3S — CID 63860370

IUPACN-[2-methyl-1-(oxolan-3-ylmethylamino)propan-2-yl]methanesulfonamide
SMILESCC(C)(CNCC1CCOC1)NS(C)(=O)=O
InChIInChI=1S/C10H22N2O3S/c1-10(2,12-16(3,13)14)8-11-6-9-4-5-15-7-9/h9,11-12H,4-8H2,1-3H3
InChIKeyFHUAVGUIIGUQPG-UHFFFAOYSA-N
MW250.36 g/mol
LogP-0.06
Rot. Bonds6

About N-[2-methyl-1-(oxolan-3-ylmethylamino)propan-2-yl]methanesulfonamide

N-[2-methyl-1-(oxolan-3-ylmethylamino)propan-2-yl]methanesulfonamide (PubChem CID 63860370) has the molecular formula C10H22N2O3S and a molecular weight of 250.36 g/mol. Its IUPAC name is N-[2-methyl-1-(oxolan-3-ylmethylamino)propan-2-yl]methanesulfonamide.

Molecular Properties

Compound NameN-[2-methyl-1-(oxolan-3-ylmethylamino)propan-2-yl]methanesulfonamide
PubChem CID63860370
Molecular FormulaC10H22N2O3S
Molecular Weight250.36 g/mol
Exact Mass250.14
IUPAC NameN-[2-methyl-1-(oxolan-3-ylmethylamino)propan-2-yl]methanesulfonamide
SMILESCC(C)(CNCC1CCOC1)NS(C)(=O)=O
InChIInChI=1S/C10H22N2O3S/c1-10(2,12-16(3,13)14)8-11-6-9-4-5-15-7-9/h9,11-12H,4-8H2,1-3H3
InChIKeyFHUAVGUIIGUQPG-UHFFFAOYSA-N
XLogP-0.06
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.36
LogP ≤ 5-0.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-1-(oxolan-3-ylmethylamino)propan-2-yl]methanesulfonamide?
The IUPAC name of N-[2-methyl-1-(oxolan-3-ylmethylamino)propan-2-yl]methanesulfonamide (CID 63860370) is N-[2-methyl-1-(oxolan-3-ylmethylamino)propan-2-yl]methanesulfonamide.
What is the SMILES notation for N-[2-methyl-1-(oxolan-3-ylmethylamino)propan-2-yl]methanesulfonamide?
The canonical SMILES for N-[2-methyl-1-(oxolan-3-ylmethylamino)propan-2-yl]methanesulfonamide is CC(C)(CNCC1CCOC1)NS(C)(=O)=O.
What is the InChIKey of N-[2-methyl-1-(oxolan-3-ylmethylamino)propan-2-yl]methanesulfonamide?
The InChIKey is FHUAVGUIIGUQPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O3S/c1-10(2,12-16(3,13)14)8-11-6-9-4-5-15-7-9/h9,11-12H,4-8H2,1-3H3.
What are the key properties of N-[2-methyl-1-(oxolan-3-ylmethylamino)propan-2-yl]methanesulfonamide?
N-[2-methyl-1-(oxolan-3-ylmethylamino)propan-2-yl]methanesulfonamide has a molecular weight of 250.36 g/mol, XLogP of -0.06, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-1-(oxolan-3-ylmethylamino)propan-2-yl]methanesulfonamide is sourced from PubChem (CID 63860370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).