2-[3-[2-methyl-6-[(5-methyl-1,3-thiazol-2-yl)amino]pyrimidin-4-yl]pyrrolidin-1-yl]ethanol

C15H21N5OS — CID 155985356

IUPAC2-[3-[2-methyl-6-[(5-methyl-1,3-thiazol-2-yl)amino]pyrimidin-4-yl]pyrrolidin-1-yl]ethanol
SMILESCc1nc(Nc2ncc(C)s2)cc(C2CCN(CCO)C2)n1
InChIInChI=1S/C15H21N5OS/c1-10-8-16-15(22-10)19-14-7-13(17-11(2)18-14)12-3-4-20(9-12)5-6-21/h7-8,12,21H,3-6,9H2,1-2H3,(H,16,17,18,19)
InChIKeyBFOSDZQBPAPPQV-UHFFFAOYSA-N
MW319.43 g/mol
LogP2.08
Rot. Bonds5

About 2-[3-[2-methyl-6-[(5-methyl-1,3-thiazol-2-yl)amino]pyrimidin-4-yl]pyrrolidin-1-yl]ethanol

2-[3-[2-methyl-6-[(5-methyl-1,3-thiazol-2-yl)amino]pyrimidin-4-yl]pyrrolidin-1-yl]ethanol (PubChem CID 155985356) has the molecular formula C15H21N5OS and a molecular weight of 319.43 g/mol. Its IUPAC name is 2-[3-[2-methyl-6-[(5-methyl-1,3-thiazol-2-yl)amino]pyrimidin-4-yl]pyrrolidin-1-yl]ethanol.

Molecular Properties

Compound Name2-[3-[2-methyl-6-[(5-methyl-1,3-thiazol-2-yl)amino]pyrimidin-4-yl]pyrrolidin-1-yl]ethanol
PubChem CID155985356
Molecular FormulaC15H21N5OS
Molecular Weight319.43 g/mol
Exact Mass319.15
IUPAC Name2-[3-[2-methyl-6-[(5-methyl-1,3-thiazol-2-yl)amino]pyrimidin-4-yl]pyrrolidin-1-yl]ethanol
SMILESCc1nc(Nc2ncc(C)s2)cc(C2CCN(CCO)C2)n1
InChIInChI=1S/C15H21N5OS/c1-10-8-16-15(22-10)19-14-7-13(17-11(2)18-14)12-3-4-20(9-12)5-6-21/h7-8,12,21H,3-6,9H2,1-2H3,(H,16,17,18,19)
InChIKeyBFOSDZQBPAPPQV-UHFFFAOYSA-N
XLogP2.08
TPSA74.17 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.43
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 2-[3-[2-methyl-6-[(5-methyl-1,3-thiazol-2-yl)amino]pyrimidin-4-yl]pyrrolidin-1-yl]ethanol 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

1-[(3S)-3-[2-methyl-6-[(5-methyl-1,3-thiazol-2-yl)amino]pyrimidin-4-yl]pyrrolidin-1-yl]propan-1-one
CID 124999407
2-[4-[2-methyl-6-[(5-phenyl-1,3-thiazol-2-yl)amino]pyrimidin-4-yl]piperidin-1-yl]ethanol
CID 71479430
5-methyl-N-[2-methyl-6-[(3S)-1-piperidin-1-ylsulfonylpyrrolidin-3-yl]pyrimidin-4-yl]-1,3-thiazol-2-amine
CID 124977783
1-[(3S)-3-[2-methyl-6-[(5-methyl-1,3-thiazol-2-yl)amino]pyrimidin-4-yl]pyrrolidin-1-yl]-3-phenylpropan-1-one
CID 125004494
2-cyclohexyl-1-[4-[2-methyl-6-[(5-methyl-1,3-thiazol-2-yl)amino]pyrimidin-4-yl]piperidin-1-yl]ethanone
CID 110095213
N-[6-[(3S)-1-ethylpyrrolidin-3-yl]-2-methylpyrimidin-4-yl]-4-methyl-1,3-thiazol-2-amine
CID 124985635
5-methyl-N-(2-methyl-6-piperidin-2-ylpyrimidin-4-yl)-1,3-thiazol-2-amine
CID 175662363
N-[2-methyl-6-[(3S)-1-(2-methylpropyl)pyrrolidin-3-yl]pyrimidin-4-yl]-1,3-thiazol-2-amine
CID 124987053
2-[(3R)-3-[2-[(5-methyl-2-pyridinyl)amino]-1,3-thiazol-4-yl]piperidin-1-yl]ethanol
CID 95827934
[(2R)-2-[2-methyl-6-[(5-methyl-1,3-thiazol-2-yl)amino]pyrimidin-4-yl]pyrrolidin-1-yl]-[(2R)-piperidin-2-yl]methanone
CID 95821699
N-[2-methyl-6-[1-(2-methylpropyl)pyrrolidin-3-yl]pyrimidin-4-yl]-1,3,4-thiadiazol-2-amine
CID 110269981
5-methyl-N-[2-methyl-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-1,3-thiazol-2-amine
CID 139474272

Frequently Asked Questions

What is the IUPAC name of 2-[3-[2-methyl-6-[(5-methyl-1,3-thiazol-2-yl)amino]pyrimidin-4-yl]pyrrolidin-1-yl]ethanol?
The IUPAC name of 2-[3-[2-methyl-6-[(5-methyl-1,3-thiazol-2-yl)amino]pyrimidin-4-yl]pyrrolidin-1-yl]ethanol (CID 155985356) is 2-[3-[2-methyl-6-[(5-methyl-1,3-thiazol-2-yl)amino]pyrimidin-4-yl]pyrrolidin-1-yl]ethanol.
What is the SMILES notation for 2-[3-[2-methyl-6-[(5-methyl-1,3-thiazol-2-yl)amino]pyrimidin-4-yl]pyrrolidin-1-yl]ethanol?
The canonical SMILES for 2-[3-[2-methyl-6-[(5-methyl-1,3-thiazol-2-yl)amino]pyrimidin-4-yl]pyrrolidin-1-yl]ethanol is Cc1nc(Nc2ncc(C)s2)cc(C2CCN(CCO)C2)n1.
What is the InChIKey of 2-[3-[2-methyl-6-[(5-methyl-1,3-thiazol-2-yl)amino]pyrimidin-4-yl]pyrrolidin-1-yl]ethanol?
The InChIKey is BFOSDZQBPAPPQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5OS/c1-10-8-16-15(22-10)19-14-7-13(17-11(2)18-14)12-3-4-20(9-12)5-6-21/h7-8,12,21H,3-6,9H2,1-2H3,(H,16,17,18,19).
What are the key properties of 2-[3-[2-methyl-6-[(5-methyl-1,3-thiazol-2-yl)amino]pyrimidin-4-yl]pyrrolidin-1-yl]ethanol?
2-[3-[2-methyl-6-[(5-methyl-1,3-thiazol-2-yl)amino]pyrimidin-4-yl]pyrrolidin-1-yl]ethanol has a molecular weight of 319.43 g/mol, XLogP of 2.08, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[2-methyl-6-[(5-methyl-1,3-thiazol-2-yl)amino]pyrimidin-4-yl]pyrrolidin-1-yl]ethanol is sourced from PubChem (CID 155985356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).