N-(2-aminoethyl)-N-methyl-2-pyridin-2-ylethanesulfonamide

C10H17N3O2S — CID 61349685

IUPACN-(2-aminoethyl)-N-methyl-2-pyridin-2-ylethanesulfonamide
SMILESCN(CCN)S(=O)(=O)CCc1ccccn1
InChIInChI=1S/C10H17N3O2S/c1-13(8-6-11)16(14,15)9-5-10-4-2-3-7-12-10/h2-4,7H,5-6,8-9,11H2,1H3
InChIKeyQNNMJHIQGZWGOG-UHFFFAOYSA-N
MW243.33 g/mol
LogP-0.16
Rot. Bonds6

About N-(2-aminoethyl)-N-methyl-2-pyridin-2-ylethanesulfonamide

N-(2-aminoethyl)-N-methyl-2-pyridin-2-ylethanesulfonamide (PubChem CID 61349685) has the molecular formula C10H17N3O2S and a molecular weight of 243.33 g/mol. Its IUPAC name is N-(2-aminoethyl)-N-methyl-2-pyridin-2-ylethanesulfonamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-N-methyl-2-pyridin-2-ylethanesulfonamide
PubChem CID61349685
Molecular FormulaC10H17N3O2S
Molecular Weight243.33 g/mol
Exact Mass243.10
IUPAC NameN-(2-aminoethyl)-N-methyl-2-pyridin-2-ylethanesulfonamide
SMILESCN(CCN)S(=O)(=O)CCc1ccccn1
InChIInChI=1S/C10H17N3O2S/c1-13(8-6-11)16(14,15)9-5-10-4-2-3-7-12-10/h2-4,7H,5-6,8-9,11H2,1H3
InChIKeyQNNMJHIQGZWGOG-UHFFFAOYSA-N
XLogP-0.16
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.33
LogP ≤ 5-0.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-hydroxybutyl)-N-methyl-2-pyridin-2-ylethanesulfonamide
CID 115756308
ethyl 2-[methyl(2-pyridin-2-ylethylsulfonyl)amino]acetate
CID 55008366
1-cyano-N-methyl-N-(2-pyridin-2-ylethyl)methanesulfonamide
CID 60677937
4-[methyl(2-pyridin-2-ylethyl)sulfamoyl]butanoic acid
CID 28774366
N-[(3-bromophenyl)methyl]-N-methyl-2-pyridin-2-ylethanesulfonamide
CID 61067284
N-(4-aminocyclohexyl)-N-methyl-2-pyridin-2-ylethanesulfonamide
CID 79120995
N-(2-amino-1-cyclopropylethyl)-N-methyl-2-pyridin-2-ylethanesulfonamide
CID 116652205
N-(2-aminoethyl)-N-methyl-2-pyridin-2-ylacetamide
CID 62681126
N-(3-bromopropyl)-N-propan-2-yl-2-pyridin-2-ylethanesulfonamide
CID 80673058
N-(2-bromoethyl)-2-pyridin-2-yl-N-(2,2,2-trifluoroethyl)ethanesulfonamide
CID 107492929
N-methyl-N-[4-(methylamino)cyclohexyl]-2-pyridin-2-ylethanesulfonamide
CID 79116756
N-(2-chloroethyl)-N-pentan-3-yl-2-pyridin-2-ylethanesulfonamide
CID 63400421

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-N-methyl-2-pyridin-2-ylethanesulfonamide?
The IUPAC name of N-(2-aminoethyl)-N-methyl-2-pyridin-2-ylethanesulfonamide (CID 61349685) is N-(2-aminoethyl)-N-methyl-2-pyridin-2-ylethanesulfonamide.
What is the SMILES notation for N-(2-aminoethyl)-N-methyl-2-pyridin-2-ylethanesulfonamide?
The canonical SMILES for N-(2-aminoethyl)-N-methyl-2-pyridin-2-ylethanesulfonamide is CN(CCN)S(=O)(=O)CCc1ccccn1.
What is the InChIKey of N-(2-aminoethyl)-N-methyl-2-pyridin-2-ylethanesulfonamide?
The InChIKey is QNNMJHIQGZWGOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2S/c1-13(8-6-11)16(14,15)9-5-10-4-2-3-7-12-10/h2-4,7H,5-6,8-9,11H2,1H3.
What are the key properties of N-(2-aminoethyl)-N-methyl-2-pyridin-2-ylethanesulfonamide?
N-(2-aminoethyl)-N-methyl-2-pyridin-2-ylethanesulfonamide has a molecular weight of 243.33 g/mol, XLogP of -0.16, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-N-methyl-2-pyridin-2-ylethanesulfonamide is sourced from PubChem (CID 61349685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).