4-methyl-5-[[4-[[5-(1-methylimidazol-2-yl)pyrazin-2-yl]methyl]piperidin-1-yl]methyl]-1,3-thiazole

C19H24N6S — CID 110099760

IUPAC4-methyl-5-[[4-[[5-(1-methylimidazol-2-yl)pyrazin-2-yl]methyl]piperidin-1-yl]methyl]-1,3-thiazole
SMILESCc1ncsc1CN1CCC(Cc2cnc(-c3nccn3C)cn2)CC1
InChIInChI=1S/C19H24N6S/c1-14-18(26-13-23-14)12-25-6-3-15(4-7-25)9-16-10-22-17(11-21-16)19-20-5-8-24(19)2/h5,8,10-11,13,15H,3-4,6-7,9,12H2,1-2H3
InChIKeyRBNXLTHSUWPFDX-UHFFFAOYSA-N
MW368.51 g/mol
LogP3.10
Rot. Bonds5

About 4-methyl-5-[[4-[[5-(1-methylimidazol-2-yl)pyrazin-2-yl]methyl]piperidin-1-yl]methyl]-1,3-thiazole

4-methyl-5-[[4-[[5-(1-methylimidazol-2-yl)pyrazin-2-yl]methyl]piperidin-1-yl]methyl]-1,3-thiazole (PubChem CID 110099760) has the molecular formula C19H24N6S and a molecular weight of 368.51 g/mol. Its IUPAC name is 4-methyl-5-[[4-[[5-(1-methylimidazol-2-yl)pyrazin-2-yl]methyl]piperidin-1-yl]methyl]-1,3-thiazole.

Molecular Properties

Compound Name4-methyl-5-[[4-[[5-(1-methylimidazol-2-yl)pyrazin-2-yl]methyl]piperidin-1-yl]methyl]-1,3-thiazole
PubChem CID110099760
Molecular FormulaC19H24N6S
Molecular Weight368.51 g/mol
Exact Mass368.18
IUPAC Name4-methyl-5-[[4-[[5-(1-methylimidazol-2-yl)pyrazin-2-yl]methyl]piperidin-1-yl]methyl]-1,3-thiazole
SMILESCc1ncsc1CN1CCC(Cc2cnc(-c3nccn3C)cn2)CC1
InChIInChI=1S/C19H24N6S/c1-14-18(26-13-23-14)12-25-6-3-15(4-7-25)9-16-10-22-17(11-21-16)19-20-5-8-24(19)2/h5,8,10-11,13,15H,3-4,6-7,9,12H2,1-2H3
InChIKeyRBNXLTHSUWPFDX-UHFFFAOYSA-N
XLogP3.10
TPSA59.73 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.51
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 4-methyl-5-[[4-[[5-(1-methylimidazol-2-yl)pyrazin-2-yl]methyl]piperidin-1-yl]methyl]-1,3-thiazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-[[4-[[5-(1-methylimidazol-2-yl)pyrazin-2-yl]methyl]piperidin-1-yl]methyl]-1,3-thiazole?
The IUPAC name of 4-methyl-5-[[4-[[5-(1-methylimidazol-2-yl)pyrazin-2-yl]methyl]piperidin-1-yl]methyl]-1,3-thiazole (CID 110099760) is 4-methyl-5-[[4-[[5-(1-methylimidazol-2-yl)pyrazin-2-yl]methyl]piperidin-1-yl]methyl]-1,3-thiazole.
What is the SMILES notation for 4-methyl-5-[[4-[[5-(1-methylimidazol-2-yl)pyrazin-2-yl]methyl]piperidin-1-yl]methyl]-1,3-thiazole?
The canonical SMILES for 4-methyl-5-[[4-[[5-(1-methylimidazol-2-yl)pyrazin-2-yl]methyl]piperidin-1-yl]methyl]-1,3-thiazole is Cc1ncsc1CN1CCC(Cc2cnc(-c3nccn3C)cn2)CC1.
What is the InChIKey of 4-methyl-5-[[4-[[5-(1-methylimidazol-2-yl)pyrazin-2-yl]methyl]piperidin-1-yl]methyl]-1,3-thiazole?
The InChIKey is RBNXLTHSUWPFDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N6S/c1-14-18(26-13-23-14)12-25-6-3-15(4-7-25)9-16-10-22-17(11-21-16)19-20-5-8-24(19)2/h5,8,10-11,13,15H,3-4,6-7,9,12H2,1-2H3.
What are the key properties of 4-methyl-5-[[4-[[5-(1-methylimidazol-2-yl)pyrazin-2-yl]methyl]piperidin-1-yl]methyl]-1,3-thiazole?
4-methyl-5-[[4-[[5-(1-methylimidazol-2-yl)pyrazin-2-yl]methyl]piperidin-1-yl]methyl]-1,3-thiazole has a molecular weight of 368.51 g/mol, XLogP of 3.10, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-[[4-[[5-(1-methylimidazol-2-yl)pyrazin-2-yl]methyl]piperidin-1-yl]methyl]-1,3-thiazole is sourced from PubChem (CID 110099760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).