N-(2-methoxyphenyl)-N-methyl-1-piperidin-2-ylmethanesulfonamide

C14H22N2O3S — CID 62003997

IUPACN-(2-methoxyphenyl)-N-methyl-1-piperidin-2-ylmethanesulfonamide
SMILESCOc1ccccc1N(C)S(=O)(=O)CC1CCCCN1
InChIInChI=1S/C14H22N2O3S/c1-16(13-8-3-4-9-14(13)19-2)20(17,18)11-12-7-5-6-10-15-12/h3-4,8-9,12,15H,5-7,10-11H2,1-2H3
InChIKeyGOOUJBFLEFBARN-UHFFFAOYSA-N
MW298.41 g/mol
LogP1.60
Rot. Bonds5

About N-(2-methoxyphenyl)-N-methyl-1-piperidin-2-ylmethanesulfonamide

N-(2-methoxyphenyl)-N-methyl-1-piperidin-2-ylmethanesulfonamide (PubChem CID 62003997) has the molecular formula C14H22N2O3S and a molecular weight of 298.41 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-N-methyl-1-piperidin-2-ylmethanesulfonamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-N-methyl-1-piperidin-2-ylmethanesulfonamide
PubChem CID62003997
Molecular FormulaC14H22N2O3S
Molecular Weight298.41 g/mol
Exact Mass298.14
IUPAC NameN-(2-methoxyphenyl)-N-methyl-1-piperidin-2-ylmethanesulfonamide
SMILESCOc1ccccc1N(C)S(=O)(=O)CC1CCCCN1
InChIInChI=1S/C14H22N2O3S/c1-16(13-8-3-4-9-14(13)19-2)20(17,18)11-12-7-5-6-10-15-12/h3-4,8-9,12,15H,5-7,10-11H2,1-2H3
InChIKeyGOOUJBFLEFBARN-UHFFFAOYSA-N
XLogP1.60
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.41
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methoxy-N-methyl-N-(3-piperidin-2-ylpropyl)aniline
CID 62213433
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CID 117455721
1-(2-methoxyphenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine
CID 106623052
N-methyl-N-[2-(pyrrolidin-2-ylmethyl)phenyl]methanesulfonamide
CID 117424887
2-(azepan-2-yl)-1-(2-methoxyphenyl)ethanone
CID 79536019
N-(2-methoxyphenyl)-N-methylmethanesulfonamide
CID 61061885
N-cycloheptyl-N-methyl-1-pyrrolidin-2-ylmethanesulfonamide
CID 54972486
N-(2-methoxyphenyl)-N-methyl-2-(propan-2-ylamino)ethanesulfonamide
CID 62003809
1-(2-methoxyphenyl)-4-piperidin-2-ylbutan-2-one
CID 116563786
N-[2-(dimethylamino)ethyl]-N-methyl-1-piperidin-2-ylmethanesulfonamide
CID 55227545
N-ethyl-3-methoxy-2-nitro-N-(piperidin-2-ylmethyl)aniline
CID 106641581
N-cyclopropyl-2-methylsulfonyl-N-(piperidin-2-ylmethyl)aniline
CID 106641104

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-N-methyl-1-piperidin-2-ylmethanesulfonamide?
The IUPAC name of N-(2-methoxyphenyl)-N-methyl-1-piperidin-2-ylmethanesulfonamide (CID 62003997) is N-(2-methoxyphenyl)-N-methyl-1-piperidin-2-ylmethanesulfonamide.
What is the SMILES notation for N-(2-methoxyphenyl)-N-methyl-1-piperidin-2-ylmethanesulfonamide?
The canonical SMILES for N-(2-methoxyphenyl)-N-methyl-1-piperidin-2-ylmethanesulfonamide is COc1ccccc1N(C)S(=O)(=O)CC1CCCCN1.
What is the InChIKey of N-(2-methoxyphenyl)-N-methyl-1-piperidin-2-ylmethanesulfonamide?
The InChIKey is GOOUJBFLEFBARN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3S/c1-16(13-8-3-4-9-14(13)19-2)20(17,18)11-12-7-5-6-10-15-12/h3-4,8-9,12,15H,5-7,10-11H2,1-2H3.
What are the key properties of N-(2-methoxyphenyl)-N-methyl-1-piperidin-2-ylmethanesulfonamide?
N-(2-methoxyphenyl)-N-methyl-1-piperidin-2-ylmethanesulfonamide has a molecular weight of 298.41 g/mol, XLogP of 1.60, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-N-methyl-1-piperidin-2-ylmethanesulfonamide is sourced from PubChem (CID 62003997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).