3-(4,4-diethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine

C15H25N3O2S — CID 63161871

IUPAC3-(4,4-diethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine
SMILESCCC1(CC)CCN(S(=O)(=O)c2cccnc2NC)CC1
InChIInChI=1S/C15H25N3O2S/c1-4-15(5-2)8-11-18(12-9-15)21(19,20)13-7-6-10-17-14(13)16-3/h6-7,10H,4-5,8-9,11-12H2,1-3H3,(H,16,17)
InChIKeyUVDHWBGXJGGODF-UHFFFAOYSA-N
MW311.45 g/mol
LogP2.71
Rot. Bonds5

About 3-(4,4-diethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine

3-(4,4-diethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine (PubChem CID 63161871) has the molecular formula C15H25N3O2S and a molecular weight of 311.45 g/mol. Its IUPAC name is 3-(4,4-diethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine.

Molecular Properties

Compound Name3-(4,4-diethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine
PubChem CID63161871
Molecular FormulaC15H25N3O2S
Molecular Weight311.45 g/mol
Exact Mass311.17
IUPAC Name3-(4,4-diethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine
SMILESCCC1(CC)CCN(S(=O)(=O)c2cccnc2NC)CC1
InChIInChI=1S/C15H25N3O2S/c1-4-15(5-2)8-11-18(12-9-15)21(19,20)13-7-6-10-17-14(13)16-3/h6-7,10H,4-5,8-9,11-12H2,1-3H3,(H,16,17)
InChIKeyUVDHWBGXJGGODF-UHFFFAOYSA-N
XLogP2.71
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.45
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(4-ethylpiperazin-1-yl)sulfonyl-N-methylpyridin-2-amine
CID 55044035
2-(4,4-diethylpiperidin-1-yl)sulfonyl-N-methylpyridin-3-amine
CID 103305907
1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]-4-methylpiperidin-4-ol
CID 81108237
2-(4,4-diethylpiperidin-1-yl)sulfonylaniline
CID 63156931
2-[4-[[2-(methylamino)-3-pyridinyl]sulfonyl]-1,4-diazepan-1-yl]ethanol
CID 107226271
4-[[2-(methylamino)-3-pyridinyl]sulfonyl]piperazin-2-one
CID 62144746
3-(3-ethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine
CID 62146476
N-ethyl-3-(4-methylpiperazin-1-yl)sulfonylpyridin-2-amine
CID 55043901
3-(azocan-1-ylsulfonyl)-N-propylpyridin-2-amine
CID 62150305
N-ethyl-3-(4-propylpiperazin-1-yl)sulfonylpyridin-2-amine
CID 62148584
[4-[[2-(methylamino)-3-pyridinyl]sulfonyl]morpholin-2-yl]methanol
CID 81213010
3-(2,3,3a,4,5,6,7,7a-octahydroindol-1-ylsulfonyl)-N-methylpyridin-2-amine
CID 82753381

Frequently Asked Questions

What is the IUPAC name of 3-(4,4-diethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine?
The IUPAC name of 3-(4,4-diethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine (CID 63161871) is 3-(4,4-diethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine.
What is the SMILES notation for 3-(4,4-diethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine?
The canonical SMILES for 3-(4,4-diethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine is CCC1(CC)CCN(S(=O)(=O)c2cccnc2NC)CC1.
What is the InChIKey of 3-(4,4-diethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine?
The InChIKey is UVDHWBGXJGGODF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2S/c1-4-15(5-2)8-11-18(12-9-15)21(19,20)13-7-6-10-17-14(13)16-3/h6-7,10H,4-5,8-9,11-12H2,1-3H3,(H,16,17).
What are the key properties of 3-(4,4-diethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine?
3-(4,4-diethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine has a molecular weight of 311.45 g/mol, XLogP of 2.71, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4,4-diethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine is sourced from PubChem (CID 63161871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).