4-(aminomethyl)-5-chloro-N-methyl-N-(2-methylsulfonylethyl)pyridin-2-amine

C10H16ClN3O2S — CID 114926756

IUPAC4-(aminomethyl)-5-chloro-N-methyl-N-(2-methylsulfonylethyl)pyridin-2-amine
SMILESCN(CCS(C)(=O)=O)c1cc(CN)c(Cl)cn1
InChIInChI=1S/C10H16ClN3O2S/c1-14(3-4-17(2,15)16)10-5-8(6-12)9(11)7-13-10/h5,7H,3-4,6,12H2,1-2H3
InChIKeyHVMLVRXQIZAFEB-UHFFFAOYSA-N
MW277.78 g/mol
LogP0.67
Rot. Bonds5

About 4-(aminomethyl)-5-chloro-N-methyl-N-(2-methylsulfonylethyl)pyridin-2-amine

4-(aminomethyl)-5-chloro-N-methyl-N-(2-methylsulfonylethyl)pyridin-2-amine (PubChem CID 114926756) has the molecular formula C10H16ClN3O2S and a molecular weight of 277.78 g/mol. Its IUPAC name is 4-(aminomethyl)-5-chloro-N-methyl-N-(2-methylsulfonylethyl)pyridin-2-amine.

Molecular Properties

Compound Name4-(aminomethyl)-5-chloro-N-methyl-N-(2-methylsulfonylethyl)pyridin-2-amine
PubChem CID114926756
Molecular FormulaC10H16ClN3O2S
Molecular Weight277.78 g/mol
Exact Mass277.07
IUPAC Name4-(aminomethyl)-5-chloro-N-methyl-N-(2-methylsulfonylethyl)pyridin-2-amine
SMILESCN(CCS(C)(=O)=O)c1cc(CN)c(Cl)cn1
InChIInChI=1S/C10H16ClN3O2S/c1-14(3-4-17(2,15)16)10-5-8(6-12)9(11)7-13-10/h5,7H,3-4,6,12H2,1-2H3
InChIKeyHVMLVRXQIZAFEB-UHFFFAOYSA-N
XLogP0.67
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.78
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-chloro-4-[(cyclopropylamino)methyl]-N-methyl-N-(2-methylsulfonylethyl)pyridin-2-amine
CID 114926757
4-N-methyl-4-N-(2-methylsulfonylethyl)pyrimidine-4,6-diamine
CID 78930007
4-(aminomethyl)-5-chloro-N-methyl-N-(2-methylbutyl)pyridin-2-amine
CID 114925467
4-(aminomethyl)-5-chloro-N-[(2-chlorophenyl)methyl]-N-methylpyridin-2-amine
CID 114926248
4-(aminomethyl)-5-chloro-N-methyl-N-[(4-methylphenyl)methyl]pyridin-2-amine
CID 114925259
5-chloro-4-(chloromethyl)-N-methyl-N-propylpyridin-2-amine
CID 114920828
4-(aminomethyl)-5-chloro-N-cyclopropyl-N-methylpyridin-2-amine
CID 114925351
4-(aminomethyl)-5-chloro-N-[(2-methoxyphenyl)methyl]-N-methylpyridin-2-amine
CID 114925953
4-(aminomethyl)-N-[(5-bromothiophen-3-yl)methyl]-5-chloro-N-methylpyridin-2-amine
CID 114926094
6-chloro-N-methyl-N-(2-methylsulfonylethyl)pyridin-2-amine
CID 79864794
N'-[4-(aminomethyl)-5-chloro-2-pyridinyl]-N,N-dimethyl-N'-(2-methylpropyl)ethane-1,2-diamine
CID 114925738
5-chloro-6-(chloromethyl)-N-methyl-N-(2-methylsulfonylethyl)pyridin-2-amine
CID 79850485

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-5-chloro-N-methyl-N-(2-methylsulfonylethyl)pyridin-2-amine?
The IUPAC name of 4-(aminomethyl)-5-chloro-N-methyl-N-(2-methylsulfonylethyl)pyridin-2-amine (CID 114926756) is 4-(aminomethyl)-5-chloro-N-methyl-N-(2-methylsulfonylethyl)pyridin-2-amine.
What is the SMILES notation for 4-(aminomethyl)-5-chloro-N-methyl-N-(2-methylsulfonylethyl)pyridin-2-amine?
The canonical SMILES for 4-(aminomethyl)-5-chloro-N-methyl-N-(2-methylsulfonylethyl)pyridin-2-amine is CN(CCS(C)(=O)=O)c1cc(CN)c(Cl)cn1.
What is the InChIKey of 4-(aminomethyl)-5-chloro-N-methyl-N-(2-methylsulfonylethyl)pyridin-2-amine?
The InChIKey is HVMLVRXQIZAFEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16ClN3O2S/c1-14(3-4-17(2,15)16)10-5-8(6-12)9(11)7-13-10/h5,7H,3-4,6,12H2,1-2H3.
What are the key properties of 4-(aminomethyl)-5-chloro-N-methyl-N-(2-methylsulfonylethyl)pyridin-2-amine?
4-(aminomethyl)-5-chloro-N-methyl-N-(2-methylsulfonylethyl)pyridin-2-amine has a molecular weight of 277.78 g/mol, XLogP of 0.67, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-5-chloro-N-methyl-N-(2-methylsulfonylethyl)pyridin-2-amine is sourced from PubChem (CID 114926756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).