N-ethyl-6-[[methyl(2-methylsulfanylethyl)amino]methyl]pyridin-2-amine

C12H21N3S — CID 112664282

IUPACN-ethyl-6-[[methyl(2-methylsulfanylethyl)amino]methyl]pyridin-2-amine
SMILESCCNc1cccc(CN(C)CCSC)n1
InChIInChI=1S/C12H21N3S/c1-4-13-12-7-5-6-11(14-12)10-15(2)8-9-16-3/h5-7H,4,8-10H2,1-3H3,(H,13,14)
InChIKeyLDANPPRYWKMZHY-UHFFFAOYSA-N
MW239.39 g/mol
LogP2.31
Rot. Bonds7

About N-ethyl-6-[[methyl(2-methylsulfanylethyl)amino]methyl]pyridin-2-amine

N-ethyl-6-[[methyl(2-methylsulfanylethyl)amino]methyl]pyridin-2-amine (PubChem CID 112664282) has the molecular formula C12H21N3S and a molecular weight of 239.39 g/mol. Its IUPAC name is N-ethyl-6-[[methyl(2-methylsulfanylethyl)amino]methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-ethyl-6-[[methyl(2-methylsulfanylethyl)amino]methyl]pyridin-2-amine
PubChem CID112664282
Molecular FormulaC12H21N3S
Molecular Weight239.39 g/mol
Exact Mass239.15
IUPAC NameN-ethyl-6-[[methyl(2-methylsulfanylethyl)amino]methyl]pyridin-2-amine
SMILESCCNc1cccc(CN(C)CCSC)n1
InChIInChI=1S/C12H21N3S/c1-4-13-12-7-5-6-11(14-12)10-15(2)8-9-16-3/h5-7H,4,8-10H2,1-3H3,(H,13,14)
InChIKeyLDANPPRYWKMZHY-UHFFFAOYSA-N
XLogP2.31
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.39
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-ethyl-6-[[methyl(2-methylsulfanylethyl)amino]methyl]pyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-ethyl-6-[[methyl(propyl)amino]methyl]pyridin-2-amine
CID 79243084
6-[[2-ethoxyethyl(methyl)amino]methyl]-N-ethylpyridin-2-amine
CID 81073763
N-ethyl-5-[[methyl(2-methylsulfanylethyl)amino]methyl]pyrazin-2-amine
CID 103056804
N-ethyl-6-[[methyl(2-pyrrolidin-1-ylethyl)amino]methyl]pyridin-2-amine
CID 79233110
N-ethyl-6-[[methyl(pyridin-2-ylmethyl)amino]methyl]pyridin-2-amine
CID 79243794
N-ethyl-6-[[methyl-[(5-methylfuran-2-yl)methyl]amino]methyl]pyridin-2-amine
CID 79243174
6-[2-(dimethylamino)ethylsulfanyl]-N-ethylpyridin-2-amine
CID 80894664
N-ethyl-6-[[1-methoxypropan-2-yl(methyl)amino]methyl]pyridin-2-amine
CID 79243357
6-[(N,4-dimethylanilino)methyl]-N-ethylpyridin-2-amine
CID 79243997
3-[methyl-[[6-(propylamino)-2-pyridinyl]methyl]amino]propanenitrile
CID 79243775
6-[[methyl(1-methylsulfanylbutan-2-yl)amino]methyl]-N-propylpyridin-2-amine
CID 112664312
5-chloro-6-[[methyl(2-methylsulfanylethyl)amino]methyl]-N-propylpyridin-2-amine
CID 112664254

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-[[methyl(2-methylsulfanylethyl)amino]methyl]pyridin-2-amine?
The IUPAC name of N-ethyl-6-[[methyl(2-methylsulfanylethyl)amino]methyl]pyridin-2-amine (CID 112664282) is N-ethyl-6-[[methyl(2-methylsulfanylethyl)amino]methyl]pyridin-2-amine.
What is the SMILES notation for N-ethyl-6-[[methyl(2-methylsulfanylethyl)amino]methyl]pyridin-2-amine?
The canonical SMILES for N-ethyl-6-[[methyl(2-methylsulfanylethyl)amino]methyl]pyridin-2-amine is CCNc1cccc(CN(C)CCSC)n1.
What is the InChIKey of N-ethyl-6-[[methyl(2-methylsulfanylethyl)amino]methyl]pyridin-2-amine?
The InChIKey is LDANPPRYWKMZHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3S/c1-4-13-12-7-5-6-11(14-12)10-15(2)8-9-16-3/h5-7H,4,8-10H2,1-3H3,(H,13,14).
What are the key properties of N-ethyl-6-[[methyl(2-methylsulfanylethyl)amino]methyl]pyridin-2-amine?
N-ethyl-6-[[methyl(2-methylsulfanylethyl)amino]methyl]pyridin-2-amine has a molecular weight of 239.39 g/mol, XLogP of 2.31, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-[[methyl(2-methylsulfanylethyl)amino]methyl]pyridin-2-amine is sourced from PubChem (CID 112664282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).