[4-(2,6-dimethyl-4-pyridinyl)piperazin-1-yl]-[(4R)-3-methyl-1,3-thiazolidin-4-yl]methanone

C16H24N4OS — CID 70787122

IUPAC[4-(2,6-dimethyl-4-pyridinyl)piperazin-1-yl]-[(4R)-3-methyl-1,3-thiazolidin-4-yl]methanone
SMILESCc1cc(N2CCN(C(=O)[C@@H]3CSCN3C)CC2)cc(C)n1
InChIInChI=1S/C16H24N4OS/c1-12-8-14(9-13(2)17-12)19-4-6-20(7-5-19)16(21)15-10-22-11-18(15)3/h8-9,15H,4-7,10-11H2,1-3H3/t15-/m0/s1
InChIKeyVEWZPKLDPXIFDS-HNNXBMFYSA-N
MW320.46 g/mol
LogP1.35
Rot. Bonds2

About [4-(2,6-dimethyl-4-pyridinyl)piperazin-1-yl]-[(4R)-3-methyl-1,3-thiazolidin-4-yl]methanone

[4-(2,6-dimethyl-4-pyridinyl)piperazin-1-yl]-[(4R)-3-methyl-1,3-thiazolidin-4-yl]methanone (PubChem CID 70787122) has the molecular formula C16H24N4OS and a molecular weight of 320.46 g/mol. Its IUPAC name is [4-(2,6-dimethyl-4-pyridinyl)piperazin-1-yl]-[(4R)-3-methyl-1,3-thiazolidin-4-yl]methanone.

Molecular Properties

Compound Name[4-(2,6-dimethyl-4-pyridinyl)piperazin-1-yl]-[(4R)-3-methyl-1,3-thiazolidin-4-yl]methanone
PubChem CID70787122
Molecular FormulaC16H24N4OS
Molecular Weight320.46 g/mol
Exact Mass320.17
IUPAC Name[4-(2,6-dimethyl-4-pyridinyl)piperazin-1-yl]-[(4R)-3-methyl-1,3-thiazolidin-4-yl]methanone
SMILESCc1cc(N2CCN(C(=O)[C@@H]3CSCN3C)CC2)cc(C)n1
InChIInChI=1S/C16H24N4OS/c1-12-8-14(9-13(2)17-12)19-4-6-20(7-5-19)16(21)15-10-22-11-18(15)3/h8-9,15H,4-7,10-11H2,1-3H3/t15-/m0/s1
InChIKeyVEWZPKLDPXIFDS-HNNXBMFYSA-N
XLogP1.35
TPSA39.68 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.46
LogP ≤ 51.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze [4-(2,6-dimethyl-4-pyridinyl)piperazin-1-yl]-[(4R)-3-methyl-1,3-thiazolidin-4-yl]methanone with MolForge

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Related Compounds

[4-(3,4-dichlorophenyl)piperazin-1-yl]-[(4R)-3-methyl-1,3-thiazolidin-4-yl]methanone
CID 72857510
5-[4-(2,6-dimethyl-4-pyridinyl)piperazine-1-carbonyl]-1-(2-methoxyethyl)piperidin-2-one
CID 45192162
[(2R)-1-methylazepan-2-yl]-[4-(2-methyl-4-pyridinyl)-1,4-diazepan-1-yl]methanone
CID 97189052
4-(2,6-dimethyl-4-pyridinyl)thiomorpholine
CID 143551760
1-[4-(2,6-dimethyl-4-pyridinyl)piperazin-1-yl]-2-thiophen-2-ylethanone
CID 70787649
[4-(4-methyl-6-propan-2-ylpyrimidin-2-yl)piperazin-1-yl]-(1-methylpyrrolidin-2-yl)methanone
CID 146127363
2-(5-acetylthiophen-3-yl)-1-[4-(2,6-dimethyl-4-pyridinyl)piperazin-1-yl]ethanone
CID 70735508
[4-(2,6-dimethyl-4-pyridinyl)piperazin-1-yl]-(7-methyl-2,3-dihydro-1,4-benzodioxin-6-yl)methanone
CID 70777886
1-methyl-4-[4-(2-methyl-4-pyridinyl)-1,4-diazepane-1-carbonyl]imidazolidin-2-one
CID 70725845
(5R)-5-[3-[4-(2,6-dimethyl-4-pyridinyl)piperazin-1-yl]-3-oxopropyl]imidazolidine-2,4-dione
CID 97114558
[(1R,4S)-3,3-dimethyl-2-methylidene-1-bicyclo[2.2.1]heptanyl]-[4-(2,6-dimethyl-4-pyridinyl)piperazin-1-yl]methanone
CID 98298028
4-(2,6-dimethyl-4-pyridinyl)-N-(1H-indazol-7-yl)piperazine-1-carboxamide
CID 72885121

Frequently Asked Questions

What is the IUPAC name of [4-(2,6-dimethyl-4-pyridinyl)piperazin-1-yl]-[(4R)-3-methyl-1,3-thiazolidin-4-yl]methanone?
The IUPAC name of [4-(2,6-dimethyl-4-pyridinyl)piperazin-1-yl]-[(4R)-3-methyl-1,3-thiazolidin-4-yl]methanone (CID 70787122) is [4-(2,6-dimethyl-4-pyridinyl)piperazin-1-yl]-[(4R)-3-methyl-1,3-thiazolidin-4-yl]methanone.
What is the SMILES notation for [4-(2,6-dimethyl-4-pyridinyl)piperazin-1-yl]-[(4R)-3-methyl-1,3-thiazolidin-4-yl]methanone?
The canonical SMILES for [4-(2,6-dimethyl-4-pyridinyl)piperazin-1-yl]-[(4R)-3-methyl-1,3-thiazolidin-4-yl]methanone is Cc1cc(N2CCN(C(=O)[C@@H]3CSCN3C)CC2)cc(C)n1.
What is the InChIKey of [4-(2,6-dimethyl-4-pyridinyl)piperazin-1-yl]-[(4R)-3-methyl-1,3-thiazolidin-4-yl]methanone?
The InChIKey is VEWZPKLDPXIFDS-HNNXBMFYSA-N. The full InChI is InChI=1S/C16H24N4OS/c1-12-8-14(9-13(2)17-12)19-4-6-20(7-5-19)16(21)15-10-22-11-18(15)3/h8-9,15H,4-7,10-11H2,1-3H3/t15-/m0/s1.
What are the key properties of [4-(2,6-dimethyl-4-pyridinyl)piperazin-1-yl]-[(4R)-3-methyl-1,3-thiazolidin-4-yl]methanone?
[4-(2,6-dimethyl-4-pyridinyl)piperazin-1-yl]-[(4R)-3-methyl-1,3-thiazolidin-4-yl]methanone has a molecular weight of 320.46 g/mol, XLogP of 1.35, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2,6-dimethyl-4-pyridinyl)piperazin-1-yl]-[(4R)-3-methyl-1,3-thiazolidin-4-yl]methanone is sourced from PubChem (CID 70787122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).