6-[1-(ethylamino)propyl]-N-methyl-N-(2-methylsulfonylethyl)pyridin-3-amine

C14H25N3O2S — CID 115939736

IUPAC6-[1-(ethylamino)propyl]-N-methyl-N-(2-methylsulfonylethyl)pyridin-3-amine
SMILESCCNC(CC)c1ccc(N(C)CCS(C)(=O)=O)cn1
InChIInChI=1S/C14H25N3O2S/c1-5-13(15-6-2)14-8-7-12(11-16-14)17(3)9-10-20(4,18)19/h7-8,11,13,15H,5-6,9-10H2,1-4H3
InChIKeyIGCRJGKIFYRTNK-UHFFFAOYSA-N
MW299.44 g/mol
LogP1.62
Rot. Bonds8

About 6-[1-(ethylamino)propyl]-N-methyl-N-(2-methylsulfonylethyl)pyridin-3-amine

6-[1-(ethylamino)propyl]-N-methyl-N-(2-methylsulfonylethyl)pyridin-3-amine (PubChem CID 115939736) has the molecular formula C14H25N3O2S and a molecular weight of 299.44 g/mol. Its IUPAC name is 6-[1-(ethylamino)propyl]-N-methyl-N-(2-methylsulfonylethyl)pyridin-3-amine.

Molecular Properties

Compound Name6-[1-(ethylamino)propyl]-N-methyl-N-(2-methylsulfonylethyl)pyridin-3-amine
PubChem CID115939736
Molecular FormulaC14H25N3O2S
Molecular Weight299.44 g/mol
Exact Mass299.17
IUPAC Name6-[1-(ethylamino)propyl]-N-methyl-N-(2-methylsulfonylethyl)pyridin-3-amine
SMILESCCNC(CC)c1ccc(N(C)CCS(C)(=O)=O)cn1
InChIInChI=1S/C14H25N3O2S/c1-5-13(15-6-2)14-8-7-12(11-16-14)17(3)9-10-20(4,18)19/h7-8,11,13,15H,5-6,9-10H2,1-4H3
InChIKeyIGCRJGKIFYRTNK-UHFFFAOYSA-N
XLogP1.62
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.44
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-[1-(ethylamino)propyl]-N-methyl-N-(3-methylbutyl)pyridin-3-amine
CID 112584276
6-[1-(ethylamino)propyl]-N,N-dimethylpyridin-3-amine
CID 112584103
N-(cyclopropylmethyl)-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine
CID 112584247
2-[[6-[1-(ethylamino)propyl]-3-pyridinyl]-propan-2-ylamino]ethanol
CID 112584333
2-[[6-[1-(ethylamino)propyl]-3-pyridinyl]-methylamino]propan-1-ol
CID 104552388
N'-ethyl-N'-[6-[1-(ethylamino)propyl]-3-pyridinyl]-N,N-dimethylpropane-1,3-diamine
CID 102994077
N-methyl-N-(3-methylbutyl)-6-[1-(propylamino)propyl]pyridin-3-amine
CID 115939346
4-[1-(ethylamino)ethyl]-N-methyl-N-(2-methylsulfonylethyl)aniline
CID 79850828
N-cyclohexyl-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine
CID 115939191
3-[[6-[1-(ethylamino)propyl]-3-pyridinyl]-propan-2-ylamino]propan-1-ol
CID 115939424
N-[(5-chlorothiophen-2-yl)methyl]-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine
CID 115939367
2-[methyl-[6-[1-(methylamino)propyl]-3-pyridinyl]amino]ethanol
CID 112584231

Frequently Asked Questions

What is the IUPAC name of 6-[1-(ethylamino)propyl]-N-methyl-N-(2-methylsulfonylethyl)pyridin-3-amine?
The IUPAC name of 6-[1-(ethylamino)propyl]-N-methyl-N-(2-methylsulfonylethyl)pyridin-3-amine (CID 115939736) is 6-[1-(ethylamino)propyl]-N-methyl-N-(2-methylsulfonylethyl)pyridin-3-amine.
What is the SMILES notation for 6-[1-(ethylamino)propyl]-N-methyl-N-(2-methylsulfonylethyl)pyridin-3-amine?
The canonical SMILES for 6-[1-(ethylamino)propyl]-N-methyl-N-(2-methylsulfonylethyl)pyridin-3-amine is CCNC(CC)c1ccc(N(C)CCS(C)(=O)=O)cn1.
What is the InChIKey of 6-[1-(ethylamino)propyl]-N-methyl-N-(2-methylsulfonylethyl)pyridin-3-amine?
The InChIKey is IGCRJGKIFYRTNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2S/c1-5-13(15-6-2)14-8-7-12(11-16-14)17(3)9-10-20(4,18)19/h7-8,11,13,15H,5-6,9-10H2,1-4H3.
What are the key properties of 6-[1-(ethylamino)propyl]-N-methyl-N-(2-methylsulfonylethyl)pyridin-3-amine?
6-[1-(ethylamino)propyl]-N-methyl-N-(2-methylsulfonylethyl)pyridin-3-amine has a molecular weight of 299.44 g/mol, XLogP of 1.62, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-(ethylamino)propyl]-N-methyl-N-(2-methylsulfonylethyl)pyridin-3-amine is sourced from PubChem (CID 115939736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).