N-methyl-4-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine

C12H19N3O2S — CID 55044279

IUPACN-methyl-4-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine
SMILESCNc1cc(S(=O)(=O)N2CCCC(C)C2)ccn1
InChIInChI=1S/C12H19N3O2S/c1-10-4-3-7-15(9-10)18(16,17)11-5-6-14-12(8-11)13-2/h5-6,8,10H,3-4,7,9H2,1-2H3,(H,13,14)
InChIKeyFAJXDDSJIHPZEJ-UHFFFAOYSA-N
MW269.37 g/mol
LogP1.54
Rot. Bonds3

About N-methyl-4-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine

N-methyl-4-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine (PubChem CID 55044279) has the molecular formula C12H19N3O2S and a molecular weight of 269.37 g/mol. Its IUPAC name is N-methyl-4-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine.

Molecular Properties

Compound NameN-methyl-4-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine
PubChem CID55044279
Molecular FormulaC12H19N3O2S
Molecular Weight269.37 g/mol
Exact Mass269.12
IUPAC NameN-methyl-4-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine
SMILESCNc1cc(S(=O)(=O)N2CCCC(C)C2)ccn1
InChIInChI=1S/C12H19N3O2S/c1-10-4-3-7-15(9-10)18(16,17)11-5-6-14-12(8-11)13-2/h5-6,8,10H,3-4,7,9H2,1-2H3,(H,13,14)
InChIKeyFAJXDDSJIHPZEJ-UHFFFAOYSA-N
XLogP1.54
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[4-(3-methylpyrrolidin-1-yl)sulfonyl-2-pyridinyl]hydrazine
CID 61226431
4-(3-methoxy-4-methylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine
CID 102964531
4-(3,4-dimethoxypyrrolidin-1-yl)sulfonyl-N-methylpyridin-2-amine
CID 103538331
4-(8-azaspiro[4.5]decan-8-ylsulfonyl)-N-methylpyridin-2-amine
CID 63162051
N-methyl-5-(3-methylpyrrolidin-1-yl)sulfonylpyridin-2-amine
CID 62146923
1-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]sulfonylazepane
CID 3184670
1-[[2-(propylamino)-4-pyridinyl]sulfonyl]piperidin-3-ol
CID 62153093
4-(1,3-dihydroisoindol-2-ylsulfonyl)-N-methylpyridin-2-amine
CID 62231059
3-(3-methylpiperidin-1-yl)sulfonylbenzenesulfonamide
CID 43235652
(3S)-3-methyl-1-(4-methylphenyl)sulfonylpiperidine
CID 668967
N-methyl-4-(4-propylpiperazin-1-yl)sulfonylpyridin-2-amine
CID 62148755
(3S)-1-(4-chlorophenyl)sulfonyl-3-methylpiperidine
CID 710396

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine?
The IUPAC name of N-methyl-4-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine (CID 55044279) is N-methyl-4-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine.
What is the SMILES notation for N-methyl-4-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine?
The canonical SMILES for N-methyl-4-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine is CNc1cc(S(=O)(=O)N2CCCC(C)C2)ccn1.
What is the InChIKey of N-methyl-4-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine?
The InChIKey is FAJXDDSJIHPZEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2S/c1-10-4-3-7-15(9-10)18(16,17)11-5-6-14-12(8-11)13-2/h5-6,8,10H,3-4,7,9H2,1-2H3,(H,13,14).
What are the key properties of N-methyl-4-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine?
N-methyl-4-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine has a molecular weight of 269.37 g/mol, XLogP of 1.54, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine is sourced from PubChem (CID 55044279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).