N-methyl-1-piperidin-2-yl-N-(2-propan-2-yloxyethyl)methanesulfonamide

C12H26N2O3S — CID 81057169

IUPACN-methyl-1-piperidin-2-yl-N-(2-propan-2-yloxyethyl)methanesulfonamide
SMILESCC(C)OCCN(C)S(=O)(=O)CC1CCCCN1
InChIInChI=1S/C12H26N2O3S/c1-11(2)17-9-8-14(3)18(15,16)10-12-6-4-5-7-13-12/h11-13H,4-10H2,1-3H3
InChIKeyMGMWRDCQTZOPBC-UHFFFAOYSA-N
MW278.42 g/mol
LogP0.82
Rot. Bonds7

About N-methyl-1-piperidin-2-yl-N-(2-propan-2-yloxyethyl)methanesulfonamide

N-methyl-1-piperidin-2-yl-N-(2-propan-2-yloxyethyl)methanesulfonamide (PubChem CID 81057169) has the molecular formula C12H26N2O3S and a molecular weight of 278.42 g/mol. Its IUPAC name is N-methyl-1-piperidin-2-yl-N-(2-propan-2-yloxyethyl)methanesulfonamide.

Molecular Properties

Compound NameN-methyl-1-piperidin-2-yl-N-(2-propan-2-yloxyethyl)methanesulfonamide
PubChem CID81057169
Molecular FormulaC12H26N2O3S
Molecular Weight278.42 g/mol
Exact Mass278.17
IUPAC NameN-methyl-1-piperidin-2-yl-N-(2-propan-2-yloxyethyl)methanesulfonamide
SMILESCC(C)OCCN(C)S(=O)(=O)CC1CCCCN1
InChIInChI=1S/C12H26N2O3S/c1-11(2)17-9-8-14(3)18(15,16)10-12-6-4-5-7-13-12/h11-13H,4-10H2,1-3H3
InChIKeyMGMWRDCQTZOPBC-UHFFFAOYSA-N
XLogP0.82
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.42
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(dimethylamino)ethyl]-N-methyl-1-piperidin-2-ylmethanesulfonamide
CID 55227545
N-(cyclobutylmethyl)-N-methyl-1-piperidin-2-ylmethanesulfonamide
CID 55125771
N-methyl-N-(2-methylsulfanylethyl)-1-pyrrolidin-2-ylmethanesulfonamide
CID 112661633
N,N-bis(3-methylbutyl)-1-piperidin-2-ylmethanesulfonamide
CID 107870369
(2S)-2-(2-propan-2-yloxyethyl)piperidine
CID 28802472
N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methyl-1-piperidin-2-ylmethanesulfonamide
CID 105419208
N-(piperidin-2-ylmethyl)-2-propan-2-yloxyethanesulfonamide
CID 79593606
N,3-dimethyl-N-(2-piperidin-2-ylethyl)butane-1-sulfonamide
CID 63855870
N-methyl-N-(2-propan-2-yloxyethyl)-3-pyrrolidin-2-ylpropan-1-amine
CID 81056390
N,2-dimethyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide
CID 106630556
N-cycloheptyl-N-methyl-1-pyrrolidin-2-ylmethanesulfonamide
CID 54972486
N-methyl-2-piperidin-2-yl-N-propylethanesulfonamide
CID 60863663

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-piperidin-2-yl-N-(2-propan-2-yloxyethyl)methanesulfonamide?
The IUPAC name of N-methyl-1-piperidin-2-yl-N-(2-propan-2-yloxyethyl)methanesulfonamide (CID 81057169) is N-methyl-1-piperidin-2-yl-N-(2-propan-2-yloxyethyl)methanesulfonamide.
What is the SMILES notation for N-methyl-1-piperidin-2-yl-N-(2-propan-2-yloxyethyl)methanesulfonamide?
The canonical SMILES for N-methyl-1-piperidin-2-yl-N-(2-propan-2-yloxyethyl)methanesulfonamide is CC(C)OCCN(C)S(=O)(=O)CC1CCCCN1.
What is the InChIKey of N-methyl-1-piperidin-2-yl-N-(2-propan-2-yloxyethyl)methanesulfonamide?
The InChIKey is MGMWRDCQTZOPBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O3S/c1-11(2)17-9-8-14(3)18(15,16)10-12-6-4-5-7-13-12/h11-13H,4-10H2,1-3H3.
What are the key properties of N-methyl-1-piperidin-2-yl-N-(2-propan-2-yloxyethyl)methanesulfonamide?
N-methyl-1-piperidin-2-yl-N-(2-propan-2-yloxyethyl)methanesulfonamide has a molecular weight of 278.42 g/mol, XLogP of 0.82, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-piperidin-2-yl-N-(2-propan-2-yloxyethyl)methanesulfonamide is sourced from PubChem (CID 81057169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).