N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propane-2-sulfonamide

C12H20N2O3S — CID 61355533

IUPACN-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propane-2-sulfonamide
SMILESCOCCN(Cc1ccccn1)S(=O)(=O)C(C)C
InChIInChI=1S/C12H20N2O3S/c1-11(2)18(15,16)14(8-9-17-3)10-12-6-4-5-7-13-12/h4-7,11H,8-10H2,1-3H3
InChIKeyATEITABAJJTRES-UHFFFAOYSA-N
MW272.37 g/mol
LogP1.27
Rot. Bonds7

About N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propane-2-sulfonamide

N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propane-2-sulfonamide (PubChem CID 61355533) has the molecular formula C12H20N2O3S and a molecular weight of 272.37 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propane-2-sulfonamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propane-2-sulfonamide
PubChem CID61355533
Molecular FormulaC12H20N2O3S
Molecular Weight272.37 g/mol
Exact Mass272.12
IUPAC NameN-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propane-2-sulfonamide
SMILESCOCCN(Cc1ccccn1)S(=O)(=O)C(C)C
InChIInChI=1S/C12H20N2O3S/c1-11(2)18(15,16)14(8-9-17-3)10-12-6-4-5-7-13-12/h4-7,11H,8-10H2,1-3H3
InChIKeyATEITABAJJTRES-UHFFFAOYSA-N
XLogP1.27
TPSA59.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 51.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[2-methoxyethyl(sulfamoyl)amino]methyl]pyridine
CID 112686105
N-(2-methoxyethyl)-2-methyl-N-(pyridin-2-ylmethyl)propanamide
CID 61242497
N-(2-methylpropyl)-N-(pyridin-2-ylmethyl)methanesulfonamide
CID 59341012
2,2-difluoro-N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)acetamide
CID 103515208
N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propanamide
CID 61242673
N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)benzamide
CID 61242674
4-(2-chloroethyl)-N-(3-methoxypropyl)-N-(pyridin-2-ylmethyl)benzenesulfonamide
CID 4209599
(2S)-2-amino-N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)hexanamide
CID 103950562
ethane;N-methyl-N-(2-pyridin-2-ylethyl)propan-2-amine
CID 142585406
4-[2-methoxyethyl(pyridin-2-ylmethyl)amino]-2,3-dimethyl-4-oxobut-2-enoic acid
CID 76993144
4-chloro-N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide
CID 61052509
2-(ethylamino)-N-(2-methoxyethyl)-2-methyl-N-(pyridin-2-ylmethyl)propanamide
CID 62836098

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propane-2-sulfonamide?
The IUPAC name of N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propane-2-sulfonamide (CID 61355533) is N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propane-2-sulfonamide.
What is the SMILES notation for N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propane-2-sulfonamide?
The canonical SMILES for N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propane-2-sulfonamide is COCCN(Cc1ccccn1)S(=O)(=O)C(C)C.
What is the InChIKey of N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propane-2-sulfonamide?
The InChIKey is ATEITABAJJTRES-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O3S/c1-11(2)18(15,16)14(8-9-17-3)10-12-6-4-5-7-13-12/h4-7,11H,8-10H2,1-3H3.
What are the key properties of N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propane-2-sulfonamide?
N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propane-2-sulfonamide has a molecular weight of 272.37 g/mol, XLogP of 1.27, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-(pyridin-2-ylmethyl)propane-2-sulfonamide is sourced from PubChem (CID 61355533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).