N-(1-ethylsulfonylpropan-2-yl)-2-methylpyridin-3-amine

C11H18N2O2S — CID 115922122

IUPACN-(1-ethylsulfonylpropan-2-yl)-2-methylpyridin-3-amine
SMILESCCS(=O)(=O)CC(C)Nc1cccnc1C
InChIInChI=1S/C11H18N2O2S/c1-4-16(14,15)8-9(2)13-11-6-5-7-12-10(11)3/h5-7,9,13H,4,8H2,1-3H3
InChIKeyPOTDYLKCDZRVJN-UHFFFAOYSA-N
MW242.34 g/mol
LogP1.63
Rot. Bonds5

About N-(1-ethylsulfonylpropan-2-yl)-2-methylpyridin-3-amine

N-(1-ethylsulfonylpropan-2-yl)-2-methylpyridin-3-amine (PubChem CID 115922122) has the molecular formula C11H18N2O2S and a molecular weight of 242.34 g/mol. Its IUPAC name is N-(1-ethylsulfonylpropan-2-yl)-2-methylpyridin-3-amine.

Molecular Properties

Compound NameN-(1-ethylsulfonylpropan-2-yl)-2-methylpyridin-3-amine
PubChem CID115922122
Molecular FormulaC11H18N2O2S
Molecular Weight242.34 g/mol
Exact Mass242.11
IUPAC NameN-(1-ethylsulfonylpropan-2-yl)-2-methylpyridin-3-amine
SMILESCCS(=O)(=O)CC(C)Nc1cccnc1C
InChIInChI=1S/C11H18N2O2S/c1-4-16(14,15)8-9(2)13-11-6-5-7-12-10(11)3/h5-7,9,13H,4,8H2,1-3H3
InChIKeyPOTDYLKCDZRVJN-UHFFFAOYSA-N
XLogP1.63
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.34
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-ethylsulfonylpropan-2-yl)-2-pyrrolidin-1-ylpyridin-3-amine
CID 115922139
N-(4-methoxybutan-2-yl)-2-methylpyridin-3-amine
CID 79042219
N-heptan-4-yl-2-methylpyridin-3-amine
CID 79041717
N-(1-ethylsulfonylpropan-2-yl)-2-fluoroaniline
CID 115921635
2-methyl-N-undecan-6-ylpyridin-3-amine
CID 79042417
2-ethylsulfanyl-N-(1-ethylsulfonylpropan-2-yl)aniline
CID 115929080
1-[2-(1-ethylsulfonylpropan-2-ylamino)phenyl]ethanol
CID 113494512
N-[1-(4-ethylphenyl)propyl]-2-methylpyridin-3-amine
CID 79041976
N-(1-methylsulfonylpropan-2-yl)-2-pyrazol-1-ylpyridin-3-amine
CID 64629336
2-methyl-N-(3-methylhex-5-en-2-yl)pyridin-3-amine
CID 115922121
3-N-(1-ethylsulfonylpropan-2-yl)-4-N,4-N-dimethylpyridine-3,4-diamine
CID 113494502
2-methyl-N-[1-(2-methylphenyl)ethyl]pyridin-3-amine
CID 79041978

Frequently Asked Questions

What is the IUPAC name of N-(1-ethylsulfonylpropan-2-yl)-2-methylpyridin-3-amine?
The IUPAC name of N-(1-ethylsulfonylpropan-2-yl)-2-methylpyridin-3-amine (CID 115922122) is N-(1-ethylsulfonylpropan-2-yl)-2-methylpyridin-3-amine.
What is the SMILES notation for N-(1-ethylsulfonylpropan-2-yl)-2-methylpyridin-3-amine?
The canonical SMILES for N-(1-ethylsulfonylpropan-2-yl)-2-methylpyridin-3-amine is CCS(=O)(=O)CC(C)Nc1cccnc1C.
What is the InChIKey of N-(1-ethylsulfonylpropan-2-yl)-2-methylpyridin-3-amine?
The InChIKey is POTDYLKCDZRVJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2S/c1-4-16(14,15)8-9(2)13-11-6-5-7-12-10(11)3/h5-7,9,13H,4,8H2,1-3H3.
What are the key properties of N-(1-ethylsulfonylpropan-2-yl)-2-methylpyridin-3-amine?
N-(1-ethylsulfonylpropan-2-yl)-2-methylpyridin-3-amine has a molecular weight of 242.34 g/mol, XLogP of 1.63, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylsulfonylpropan-2-yl)-2-methylpyridin-3-amine is sourced from PubChem (CID 115922122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).