N,N-dimethyl-4-(6-methyl-4-pyrimidin-5-yl-2-pyridinyl)piperidine-1-sulfonamide

C17H23N5O2S — CID 92617323

IUPACN,N-dimethyl-4-(6-methyl-4-pyrimidin-5-yl-2-pyridinyl)piperidine-1-sulfonamide
SMILESCc1cc(-c2cncnc2)cc(C2CCN(S(=O)(=O)N(C)C)CC2)n1
InChIInChI=1S/C17H23N5O2S/c1-13-8-15(16-10-18-12-19-11-16)9-17(20-13)14-4-6-22(7-5-14)25(23,24)21(2)3/h8-12,14H,4-7H2,1-3H3
InChIKeyWUAGBCSDIQBJIU-UHFFFAOYSA-N
MW361.47 g/mol
LogP1.83
Rot. Bonds4

About N,N-dimethyl-4-(6-methyl-4-pyrimidin-5-yl-2-pyridinyl)piperidine-1-sulfonamide

N,N-dimethyl-4-(6-methyl-4-pyrimidin-5-yl-2-pyridinyl)piperidine-1-sulfonamide (PubChem CID 92617323) has the molecular formula C17H23N5O2S and a molecular weight of 361.47 g/mol. Its IUPAC name is N,N-dimethyl-4-(6-methyl-4-pyrimidin-5-yl-2-pyridinyl)piperidine-1-sulfonamide.

Molecular Properties

Compound NameN,N-dimethyl-4-(6-methyl-4-pyrimidin-5-yl-2-pyridinyl)piperidine-1-sulfonamide
PubChem CID92617323
Molecular FormulaC17H23N5O2S
Molecular Weight361.47 g/mol
Exact Mass361.16
IUPAC NameN,N-dimethyl-4-(6-methyl-4-pyrimidin-5-yl-2-pyridinyl)piperidine-1-sulfonamide
SMILESCc1cc(-c2cncnc2)cc(C2CCN(S(=O)(=O)N(C)C)CC2)n1
InChIInChI=1S/C17H23N5O2S/c1-13-8-15(16-10-18-12-19-11-16)9-17(20-13)14-4-6-22(7-5-14)25(23,24)21(2)3/h8-12,14H,4-7H2,1-3H3
InChIKeyWUAGBCSDIQBJIU-UHFFFAOYSA-N
XLogP1.83
TPSA79.29 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.47
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N,N-dimethyl-4-(6-methylpyrazin-2-yl)piperidine-1-sulfonamide
CID 95845148
N,N-dimethyl-4-[6-methyl-4-(pyrimidin-2-ylamino)-2-pyridinyl]piperidine-1-sulfonamide
CID 110093124
(1-methylpyrazol-4-yl)-[4-(6-methyl-4-pyrimidin-5-yl-2-pyridinyl)piperidin-1-yl]methanone
CID 92615374
5-[2-[(3R)-1-(dimethylsulfamoyl)pyrrolidin-3-yl]-6-methylpyrimidin-4-yl]pyridine-3-carboxylic acid
CID 124948268
1-[3-(6-methyl-4-pyrimidin-5-yl-2-pyridinyl)piperidin-1-yl]propan-1-one
CID 110252451
2-(1-hydroxycyclohexyl)-1-[(3R)-3-(6-methyl-4-pyrimidin-5-yl-2-pyridinyl)pyrrolidin-1-yl]ethanone
CID 95834644
5-fluoro-2-methyl-3-[[4-(6-methyl-4-pyrimidin-5-yl-2-pyridinyl)piperidin-1-yl]methyl]-1H-indole
CID 92617306
N,N-dimethyl-3-(6-methylpyrazin-2-yl)piperidine-1-sulfonamide
CID 110257001
3-(2-ethylimidazol-1-yl)-1-[4-(6-methyl-4-pyrimidin-5-yl-2-pyridinyl)piperidin-1-yl]propan-1-one
CID 92617351
5-[2-[(3S)-1-(dimethylsulfamoyl)piperidin-3-yl]-6-methylpyrimidin-4-yl]pyridine-3-carboxylic acid
CID 124992100
N,N-diethyl-4-[6-methyl-4-(pyrazin-2-ylamino)-2-pyridinyl]piperidine-1-sulfonamide
CID 110093129
(3R)-N,N-dimethyl-3-[6-methyl-4-[(5-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]piperidine-1-sulfonamide
CID 124949686

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-(6-methyl-4-pyrimidin-5-yl-2-pyridinyl)piperidine-1-sulfonamide?
The IUPAC name of N,N-dimethyl-4-(6-methyl-4-pyrimidin-5-yl-2-pyridinyl)piperidine-1-sulfonamide (CID 92617323) is N,N-dimethyl-4-(6-methyl-4-pyrimidin-5-yl-2-pyridinyl)piperidine-1-sulfonamide.
What is the SMILES notation for N,N-dimethyl-4-(6-methyl-4-pyrimidin-5-yl-2-pyridinyl)piperidine-1-sulfonamide?
The canonical SMILES for N,N-dimethyl-4-(6-methyl-4-pyrimidin-5-yl-2-pyridinyl)piperidine-1-sulfonamide is Cc1cc(-c2cncnc2)cc(C2CCN(S(=O)(=O)N(C)C)CC2)n1.
What is the InChIKey of N,N-dimethyl-4-(6-methyl-4-pyrimidin-5-yl-2-pyridinyl)piperidine-1-sulfonamide?
The InChIKey is WUAGBCSDIQBJIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N5O2S/c1-13-8-15(16-10-18-12-19-11-16)9-17(20-13)14-4-6-22(7-5-14)25(23,24)21(2)3/h8-12,14H,4-7H2,1-3H3.
What are the key properties of N,N-dimethyl-4-(6-methyl-4-pyrimidin-5-yl-2-pyridinyl)piperidine-1-sulfonamide?
N,N-dimethyl-4-(6-methyl-4-pyrimidin-5-yl-2-pyridinyl)piperidine-1-sulfonamide has a molecular weight of 361.47 g/mol, XLogP of 1.83, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-(6-methyl-4-pyrimidin-5-yl-2-pyridinyl)piperidine-1-sulfonamide is sourced from PubChem (CID 92617323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).