N-methyl-N-[(4-propan-2-ylmorpholin-3-yl)methyl]methanesulfonamide

C10H22N2O3S — CID 70811613

IUPACN-methyl-N-[(4-propan-2-ylmorpholin-3-yl)methyl]methanesulfonamide
SMILESCC(C)N1CCOCC1CN(C)S(C)(=O)=O
InChIInChI=1S/C10H22N2O3S/c1-9(2)12-5-6-15-8-10(12)7-11(3)16(4,13)14/h9-10H,5-8H2,1-4H3
InChIKeySPUJILPXZHVXTK-UHFFFAOYSA-N
MW250.36 g/mol
LogP-0.01
Rot. Bonds4

About N-methyl-N-[(4-propan-2-ylmorpholin-3-yl)methyl]methanesulfonamide

N-methyl-N-[(4-propan-2-ylmorpholin-3-yl)methyl]methanesulfonamide (PubChem CID 70811613) has the molecular formula C10H22N2O3S and a molecular weight of 250.36 g/mol. Its IUPAC name is N-methyl-N-[(4-propan-2-ylmorpholin-3-yl)methyl]methanesulfonamide.

Molecular Properties

Compound NameN-methyl-N-[(4-propan-2-ylmorpholin-3-yl)methyl]methanesulfonamide
PubChem CID70811613
Molecular FormulaC10H22N2O3S
Molecular Weight250.36 g/mol
Exact Mass250.14
IUPAC NameN-methyl-N-[(4-propan-2-ylmorpholin-3-yl)methyl]methanesulfonamide
SMILESCC(C)N1CCOCC1CN(C)S(C)(=O)=O
InChIInChI=1S/C10H22N2O3S/c1-9(2)12-5-6-15-8-10(12)7-11(3)16(4,13)14/h9-10H,5-8H2,1-4H3
InChIKeySPUJILPXZHVXTK-UHFFFAOYSA-N
XLogP-0.01
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.36
LogP ≤ 5-0.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(4-propan-2-ylmorpholin-3-yl)methyl]methanesulfonamide?
The IUPAC name of N-methyl-N-[(4-propan-2-ylmorpholin-3-yl)methyl]methanesulfonamide (CID 70811613) is N-methyl-N-[(4-propan-2-ylmorpholin-3-yl)methyl]methanesulfonamide.
What is the SMILES notation for N-methyl-N-[(4-propan-2-ylmorpholin-3-yl)methyl]methanesulfonamide?
The canonical SMILES for N-methyl-N-[(4-propan-2-ylmorpholin-3-yl)methyl]methanesulfonamide is CC(C)N1CCOCC1CN(C)S(C)(=O)=O.
What is the InChIKey of N-methyl-N-[(4-propan-2-ylmorpholin-3-yl)methyl]methanesulfonamide?
The InChIKey is SPUJILPXZHVXTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O3S/c1-9(2)12-5-6-15-8-10(12)7-11(3)16(4,13)14/h9-10H,5-8H2,1-4H3.
What are the key properties of N-methyl-N-[(4-propan-2-ylmorpholin-3-yl)methyl]methanesulfonamide?
N-methyl-N-[(4-propan-2-ylmorpholin-3-yl)methyl]methanesulfonamide has a molecular weight of 250.36 g/mol, XLogP of -0.01, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(4-propan-2-ylmorpholin-3-yl)methyl]methanesulfonamide is sourced from PubChem (CID 70811613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).