3-(3-ethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine

C13H21N3O2S — CID 62146476

IUPAC3-(3-ethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine
SMILESCCC1CCCN(S(=O)(=O)c2cccnc2NC)C1
InChIInChI=1S/C13H21N3O2S/c1-3-11-6-5-9-16(10-11)19(17,18)12-7-4-8-15-13(12)14-2/h4,7-8,11H,3,5-6,9-10H2,1-2H3,(H,14,15)
InChIKeyQEAYHUSMYNFFNP-UHFFFAOYSA-N
MW283.40 g/mol
LogP1.93
Rot. Bonds4

About 3-(3-ethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine

3-(3-ethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine (PubChem CID 62146476) has the molecular formula C13H21N3O2S and a molecular weight of 283.40 g/mol. Its IUPAC name is 3-(3-ethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine.

Molecular Properties

Compound Name3-(3-ethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine
PubChem CID62146476
Molecular FormulaC13H21N3O2S
Molecular Weight283.40 g/mol
Exact Mass283.14
IUPAC Name3-(3-ethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine
SMILESCCC1CCCN(S(=O)(=O)c2cccnc2NC)C1
InChIInChI=1S/C13H21N3O2S/c1-3-11-6-5-9-16(10-11)19(17,18)12-7-4-8-15-13(12)14-2/h4,7-8,11H,3,5-6,9-10H2,1-2H3,(H,14,15)
InChIKeyQEAYHUSMYNFFNP-UHFFFAOYSA-N
XLogP1.93
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.40
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-3-[3-(methoxymethyl)piperidin-1-yl]sulfonylpyridin-2-amine
CID 106588741
N-ethyl-3-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine
CID 62148841
N-methyl-3-[(2-methyl-1,4-oxazepan-4-yl)sulfonyl]pyridin-2-amine
CID 62966962
1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]piperidin-3-ol
CID 55043660
3-(4-ethylpiperazin-1-yl)sulfonyl-N-methylpyridin-2-amine
CID 55044035
3-[[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]sulfonyl]-N-methylpyridin-2-amine
CID 102728064
3-ethyl-1-naphthalen-1-ylsulfonylpiperidine
CID 114795787
N-methyl-1-(1-quinolin-8-ylsulfonylpiperidin-3-yl)methanamine
CID 119960917
[1-[[2-(methylamino)-3-pyridinyl]sulfonyl]pyrrolidin-2-yl]methanol
CID 55139274
3-(4,4-diethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine
CID 63161871
4-(3-ethylpiperidin-1-yl)sulfonyl-N-methylaniline
CID 43584842
[4-[[2-(methylamino)-3-pyridinyl]sulfonyl]morpholin-2-yl]methanol
CID 81213010

Frequently Asked Questions

What is the IUPAC name of 3-(3-ethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine?
The IUPAC name of 3-(3-ethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine (CID 62146476) is 3-(3-ethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine.
What is the SMILES notation for 3-(3-ethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine?
The canonical SMILES for 3-(3-ethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine is CCC1CCCN(S(=O)(=O)c2cccnc2NC)C1.
What is the InChIKey of 3-(3-ethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine?
The InChIKey is QEAYHUSMYNFFNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2S/c1-3-11-6-5-9-16(10-11)19(17,18)12-7-4-8-15-13(12)14-2/h4,7-8,11H,3,5-6,9-10H2,1-2H3,(H,14,15).
What are the key properties of 3-(3-ethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine?
3-(3-ethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine has a molecular weight of 283.40 g/mol, XLogP of 1.93, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-ethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine is sourced from PubChem (CID 62146476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).