N,N-diethyl-4-[6-methyl-4-(pyrazin-2-ylamino)-2-pyridinyl]piperidine-1-sulfonamide

C19H28N6O2S — CID 110093129

IUPACN,N-diethyl-4-[6-methyl-4-(pyrazin-2-ylamino)-2-pyridinyl]piperidine-1-sulfonamide
SMILESCCN(CC)S(=O)(=O)N1CCC(c2cc(Nc3cnccn3)cc(C)n2)CC1
InChIInChI=1S/C19H28N6O2S/c1-4-24(5-2)28(26,27)25-10-6-16(7-11-25)18-13-17(12-15(3)22-18)23-19-14-20-8-9-21-19/h8-9,12-14,16H,4-7,10-11H2,1-3H3,(H,21,22,23)
InChIKeyHZTZSROXELXXLI-UHFFFAOYSA-N
MW404.54 g/mol
LogP2.69
Rot. Bonds7

About N,N-diethyl-4-[6-methyl-4-(pyrazin-2-ylamino)-2-pyridinyl]piperidine-1-sulfonamide

N,N-diethyl-4-[6-methyl-4-(pyrazin-2-ylamino)-2-pyridinyl]piperidine-1-sulfonamide (PubChem CID 110093129) has the molecular formula C19H28N6O2S and a molecular weight of 404.54 g/mol. Its IUPAC name is N,N-diethyl-4-[6-methyl-4-(pyrazin-2-ylamino)-2-pyridinyl]piperidine-1-sulfonamide.

Molecular Properties

Compound NameN,N-diethyl-4-[6-methyl-4-(pyrazin-2-ylamino)-2-pyridinyl]piperidine-1-sulfonamide
PubChem CID110093129
Molecular FormulaC19H28N6O2S
Molecular Weight404.54 g/mol
Exact Mass404.20
IUPAC NameN,N-diethyl-4-[6-methyl-4-(pyrazin-2-ylamino)-2-pyridinyl]piperidine-1-sulfonamide
SMILESCCN(CC)S(=O)(=O)N1CCC(c2cc(Nc3cnccn3)cc(C)n2)CC1
InChIInChI=1S/C19H28N6O2S/c1-4-24(5-2)28(26,27)25-10-6-16(7-11-25)18-13-17(12-15(3)22-18)23-19-14-20-8-9-21-19/h8-9,12-14,16H,4-7,10-11H2,1-3H3,(H,21,22,23)
InChIKeyHZTZSROXELXXLI-UHFFFAOYSA-N
XLogP2.69
TPSA91.32 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.54
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N,N-diethyl-4-pyrazin-2-ylpiperidine-1-sulfonamide
CID 125019512
(3R)-N,N-diethyl-3-[6-methyl-4-(4-methylanilino)-2-pyridinyl]pyrrolidine-1-sulfonamide
CID 124976984
N,N-dimethyl-4-[6-methyl-4-(pyrimidin-2-ylamino)-2-pyridinyl]piperidine-1-sulfonamide
CID 110093124
1-(4-methylpiperidin-1-yl)-2-[4-[6-methyl-4-(pyrazin-2-ylamino)-2-pyridinyl]piperidin-1-yl]ethanone
CID 110093108
N-[2-[1-(4-fluoro-3-methylphenyl)sulfonylpiperidin-3-yl]-6-methyl-4-pyridinyl]pyrazin-2-amine
CID 110265009
(2S)-N,N-diethyl-2-[6-methyl-4-[(4-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]pyrrolidine-1-sulfonamide
CID 95832645
N-[2-methyl-6-[(2R)-pyrrolidin-2-yl]-4-pyridinyl]pyrazin-2-amine
CID 95814585
N,N-diethyl-4-[5-[(3-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidine-1-sulfonamide
CID 95834146
1-(3,4-dihydro-2H-quinolin-1-yl)-2-[3-[6-methyl-4-(pyrazin-2-ylamino)-2-pyridinyl]piperidin-1-yl]ethanone
CID 110264924
1-[2-[2-[(3R)-3-[6-methyl-4-(pyrazin-2-ylamino)-2-pyridinyl]piperidin-1-yl]-2-oxoethoxy]ethyl]pyrrolidin-2-one
CID 95834932
N,N-diethyl-2-[4-[6-methyl-4-(pyrimidin-2-ylamino)-2-pyridinyl]piperidin-1-yl]acetamide
CID 110093095
N-[2-[(3R)-1-[(6-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]piperidin-3-yl]-6-methyl-4-pyridinyl]pyrazin-2-amine
CID 95834980

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-4-[6-methyl-4-(pyrazin-2-ylamino)-2-pyridinyl]piperidine-1-sulfonamide?
The IUPAC name of N,N-diethyl-4-[6-methyl-4-(pyrazin-2-ylamino)-2-pyridinyl]piperidine-1-sulfonamide (CID 110093129) is N,N-diethyl-4-[6-methyl-4-(pyrazin-2-ylamino)-2-pyridinyl]piperidine-1-sulfonamide.
What is the SMILES notation for N,N-diethyl-4-[6-methyl-4-(pyrazin-2-ylamino)-2-pyridinyl]piperidine-1-sulfonamide?
The canonical SMILES for N,N-diethyl-4-[6-methyl-4-(pyrazin-2-ylamino)-2-pyridinyl]piperidine-1-sulfonamide is CCN(CC)S(=O)(=O)N1CCC(c2cc(Nc3cnccn3)cc(C)n2)CC1.
What is the InChIKey of N,N-diethyl-4-[6-methyl-4-(pyrazin-2-ylamino)-2-pyridinyl]piperidine-1-sulfonamide?
The InChIKey is HZTZSROXELXXLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N6O2S/c1-4-24(5-2)28(26,27)25-10-6-16(7-11-25)18-13-17(12-15(3)22-18)23-19-14-20-8-9-21-19/h8-9,12-14,16H,4-7,10-11H2,1-3H3,(H,21,22,23).
What are the key properties of N,N-diethyl-4-[6-methyl-4-(pyrazin-2-ylamino)-2-pyridinyl]piperidine-1-sulfonamide?
N,N-diethyl-4-[6-methyl-4-(pyrazin-2-ylamino)-2-pyridinyl]piperidine-1-sulfonamide has a molecular weight of 404.54 g/mol, XLogP of 2.69, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-4-[6-methyl-4-(pyrazin-2-ylamino)-2-pyridinyl]piperidine-1-sulfonamide is sourced from PubChem (CID 110093129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).