4-methyl-2-(1-methylpyrrolidin-2-yl)-5-phenyl-1,3-thiazole

C15H18N2S — CID 21365788

IUPAC4-methyl-2-(1-methylpyrrolidin-2-yl)-5-phenyl-1,3-thiazole
SMILESCc1nc(C2CCCN2C)sc1-c1ccccc1
InChIInChI=1S/C15H18N2S/c1-11-14(12-7-4-3-5-8-12)18-15(16-11)13-9-6-10-17(13)2/h3-5,7-8,13H,6,9-10H2,1-2H3
InChIKeyJGSCLRSNFZMOJR-UHFFFAOYSA-N
MW258.39 g/mol
LogP3.89
Rot. Bonds2

About 4-methyl-2-(1-methylpyrrolidin-2-yl)-5-phenyl-1,3-thiazole

4-methyl-2-(1-methylpyrrolidin-2-yl)-5-phenyl-1,3-thiazole (PubChem CID 21365788) has the molecular formula C15H18N2S and a molecular weight of 258.39 g/mol. Its IUPAC name is 4-methyl-2-(1-methylpyrrolidin-2-yl)-5-phenyl-1,3-thiazole.

Molecular Properties

Compound Name4-methyl-2-(1-methylpyrrolidin-2-yl)-5-phenyl-1,3-thiazole
PubChem CID21365788
Molecular FormulaC15H18N2S
Molecular Weight258.39 g/mol
Exact Mass258.12
IUPAC Name4-methyl-2-(1-methylpyrrolidin-2-yl)-5-phenyl-1,3-thiazole
SMILESCc1nc(C2CCCN2C)sc1-c1ccccc1
InChIInChI=1S/C15H18N2S/c1-11-14(12-7-4-3-5-8-12)18-15(16-11)13-9-6-10-17(13)2/h3-5,7-8,13H,6,9-10H2,1-2H3
InChIKeyJGSCLRSNFZMOJR-UHFFFAOYSA-N
XLogP3.89
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.39
LogP ≤ 53.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-methyl-2-(1-methylpyrrolidin-2-yl)-5-phenyl-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

Related Compounds

bis(4,5-dimethyl-2-(1-methylpyrrolidin-2-yl)-1,3-thiazole);N,N-dimethyl-2-(1-methylpyrrolidin-2-yl)-1,3-thiazole-4-carboxamide;4-methyl-2-(1-methylpyrrolidin-2-yl)-5-phenyl-1,3-thiazole;5-methyl-2-(1-methylpyrrolidin-2-yl)-4-phenyl-1,3-thiazole;tris(4-methyl-2-(1-methylpyrrolidin-2-yl)-1,3-thiazole);methyl 2-(1-methylpyrrolidin-2-yl)-1,3-thiazole-4-carboxylate;2-(1-methylpyrrolidin-2-yl)-4-phenyl-1,3-thiazole;2-(1-methylpyrrolidin-2-yl)-1,3-thiazole-4-carboxamide
CID 161264316
3-methyl-4-[(2S)-1-methylpyrrolidin-2-yl]-1-phenylpyrazole;hydrochloride
CID 22853235
4-(1-methylpyrrolidin-2-yl)-6-phenylpyrimidine
CID 123600076
3-(1-methylpyrrolidin-2-yl)-5-phenylpyridine
CID 19694355
1-methyl-2-phenylazepane
CID 23447707
2-cyclopropyl-5-(3-fluorophenyl)-4-methyl-1,3-thiazole
CID 58245762
5-(3-bromophenyl)-2-cyclopropyl-4-methyl-1,3-thiazole
CID 70791136
N-(1-azabicyclo[2.2.1]heptan-3-yl)-4-methyl-5-phenyl-1,3-thiazole-2-carboxamide
CID 22350586
[4-(2-cyclobutyl-4-methyl-1,3-thiazol-5-yl)phenyl]methanamine
CID 116885292
4-[(1R,2R)-2-(4-methyl-5-phenyl-1,3-thiazol-2-yl)cyclopropyl]benzenesulfonamide
CID 130448674
4-(4-fluoronaphthalen-1-yl)-2-[(2S)-1-methylpyrrolidin-2-yl]-1,3-thiazole
CID 143251676
2,4-dimethyl-5-phenyl-1,3-thiazole;fluoroform
CID 159404933

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(1-methylpyrrolidin-2-yl)-5-phenyl-1,3-thiazole?
The IUPAC name of 4-methyl-2-(1-methylpyrrolidin-2-yl)-5-phenyl-1,3-thiazole (CID 21365788) is 4-methyl-2-(1-methylpyrrolidin-2-yl)-5-phenyl-1,3-thiazole.
What is the SMILES notation for 4-methyl-2-(1-methylpyrrolidin-2-yl)-5-phenyl-1,3-thiazole?
The canonical SMILES for 4-methyl-2-(1-methylpyrrolidin-2-yl)-5-phenyl-1,3-thiazole is Cc1nc(C2CCCN2C)sc1-c1ccccc1.
What is the InChIKey of 4-methyl-2-(1-methylpyrrolidin-2-yl)-5-phenyl-1,3-thiazole?
The InChIKey is JGSCLRSNFZMOJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2S/c1-11-14(12-7-4-3-5-8-12)18-15(16-11)13-9-6-10-17(13)2/h3-5,7-8,13H,6,9-10H2,1-2H3.
What are the key properties of 4-methyl-2-(1-methylpyrrolidin-2-yl)-5-phenyl-1,3-thiazole?
4-methyl-2-(1-methylpyrrolidin-2-yl)-5-phenyl-1,3-thiazole has a molecular weight of 258.39 g/mol, XLogP of 3.89, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(1-methylpyrrolidin-2-yl)-5-phenyl-1,3-thiazole is sourced from PubChem (CID 21365788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).