N-ethyl-2-methylsulfonylpyridin-4-amine;hydrochloride

C8H13ClN2O2S — CID 67303345

IUPACN-ethyl-2-methylsulfonylpyridin-4-amine;hydrochloride
SMILESCCNc1ccnc(S(C)(=O)=O)c1.Cl
InChIInChI=1S/C8H12N2O2S.ClH/c1-3-9-7-4-5-10-8(6-7)13(2,11)12;/h4-6H,3H2,1-2H3,(H,9,10);1H
InChIKeySQJZIZWOSNGMAZ-UHFFFAOYSA-N
MW236.72 g/mol
LogP1.34
Rot. Bonds3

About N-ethyl-2-methylsulfonylpyridin-4-amine;hydrochloride

N-ethyl-2-methylsulfonylpyridin-4-amine;hydrochloride (PubChem CID 67303345) has the molecular formula C8H13ClN2O2S and a molecular weight of 236.72 g/mol. Its IUPAC name is N-ethyl-2-methylsulfonylpyridin-4-amine;hydrochloride.

Molecular Properties

Compound NameN-ethyl-2-methylsulfonylpyridin-4-amine;hydrochloride
PubChem CID67303345
Molecular FormulaC8H13ClN2O2S
Molecular Weight236.72 g/mol
Exact Mass236.04
IUPAC NameN-ethyl-2-methylsulfonylpyridin-4-amine;hydrochloride
SMILESCCNc1ccnc(S(C)(=O)=O)c1.Cl
InChIInChI=1S/C8H12N2O2S.ClH/c1-3-9-7-4-5-10-8(6-7)13(2,11)12;/h4-6H,3H2,1-2H3,(H,9,10);1H
InChIKeySQJZIZWOSNGMAZ-UHFFFAOYSA-N
XLogP1.34
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.72
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-6-methylsulfonylpyrimidin-4-amine
CID 125499129
4-butyl-2-methylsulfonylpyridine
CID 148809868
N-ethyl-2-[(4-methylsulfonylpiperazin-1-yl)methyl]pyridin-4-amine
CID 79251269
N-(2-methylsulfonyl-4-pyridinyl)-1-propan-2-ylimidazole-4-sulfonamide
CID 126831250
2-(ethoxymethyl)-N-ethylpyridin-4-amine
CID 79251240
4-ethynyl-2-methylsulfonylpyridine
CID 23436956
4-(ethylamino)-N-[2-(ethylsulfamoyl)ethyl]pyridine-2-carboxamide
CID 106342560
N-ethyl-2-(2,4,5-trimethylphenyl)pyridin-4-amine
CID 102824812
1-(2-methylsulfonyl-4-pyridinyl)ethanamine
CID 68653792
tert-butyl N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]carbamate
CID 59278290
N-(2-methylsulfonyl-4-pyridinyl)quinoline-3-carboxamide
CID 175916603
2-methylsulfonylpyridine-4-carbothioamide
CID 47003466

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methylsulfonylpyridin-4-amine;hydrochloride?
The IUPAC name of N-ethyl-2-methylsulfonylpyridin-4-amine;hydrochloride (CID 67303345) is N-ethyl-2-methylsulfonylpyridin-4-amine;hydrochloride.
What is the SMILES notation for N-ethyl-2-methylsulfonylpyridin-4-amine;hydrochloride?
The canonical SMILES for N-ethyl-2-methylsulfonylpyridin-4-amine;hydrochloride is CCNc1ccnc(S(C)(=O)=O)c1.Cl.
What is the InChIKey of N-ethyl-2-methylsulfonylpyridin-4-amine;hydrochloride?
The InChIKey is SQJZIZWOSNGMAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O2S.ClH/c1-3-9-7-4-5-10-8(6-7)13(2,11)12;/h4-6H,3H2,1-2H3,(H,9,10);1H.
What are the key properties of N-ethyl-2-methylsulfonylpyridin-4-amine;hydrochloride?
N-ethyl-2-methylsulfonylpyridin-4-amine;hydrochloride has a molecular weight of 236.72 g/mol, XLogP of 1.34, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methylsulfonylpyridin-4-amine;hydrochloride is sourced from PubChem (CID 67303345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).