6-methyl-2-[2-[3-(3-methylpyrazin-2-yl)-1,2-oxazol-5-yl]pyrrolidin-1-yl]-N-pyridin-2-ylpyrimidin-4-amine

C22H22N8O — CID 69112081

IUPAC6-methyl-2-[2-[3-(3-methylpyrazin-2-yl)-1,2-oxazol-5-yl]pyrrolidin-1-yl]-N-pyridin-2-ylpyrimidin-4-amine
SMILESCc1cc(Nc2ccccn2)nc(N2CCCC2c2cc(-c3nccnc3C)no2)n1
InChIInChI=1S/C22H22N8O/c1-14-12-20(27-19-7-3-4-8-24-19)28-22(26-14)30-11-5-6-17(30)18-13-16(29-31-18)21-15(2)23-9-10-25-21/h3-4,7-10,12-13,17H,5-6,11H2,1-2H3,(H,24,26,27,28)
InChIKeyOVSNXVUCPMLTLT-UHFFFAOYSA-N
MW414.47 g/mol
LogP4.02
Rot. Bonds5

About 6-methyl-2-[2-[3-(3-methylpyrazin-2-yl)-1,2-oxazol-5-yl]pyrrolidin-1-yl]-N-pyridin-2-ylpyrimidin-4-amine

6-methyl-2-[2-[3-(3-methylpyrazin-2-yl)-1,2-oxazol-5-yl]pyrrolidin-1-yl]-N-pyridin-2-ylpyrimidin-4-amine (PubChem CID 69112081) has the molecular formula C22H22N8O and a molecular weight of 414.47 g/mol. Its IUPAC name is 6-methyl-2-[2-[3-(3-methylpyrazin-2-yl)-1,2-oxazol-5-yl]pyrrolidin-1-yl]-N-pyridin-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-methyl-2-[2-[3-(3-methylpyrazin-2-yl)-1,2-oxazol-5-yl]pyrrolidin-1-yl]-N-pyridin-2-ylpyrimidin-4-amine
PubChem CID69112081
Molecular FormulaC22H22N8O
Molecular Weight414.47 g/mol
Exact Mass414.19
IUPAC Name6-methyl-2-[2-[3-(3-methylpyrazin-2-yl)-1,2-oxazol-5-yl]pyrrolidin-1-yl]-N-pyridin-2-ylpyrimidin-4-amine
SMILESCc1cc(Nc2ccccn2)nc(N2CCCC2c2cc(-c3nccnc3C)no2)n1
InChIInChI=1S/C22H22N8O/c1-14-12-20(27-19-7-3-4-8-24-19)28-22(26-14)30-11-5-6-17(30)18-13-16(29-31-18)21-15(2)23-9-10-25-21/h3-4,7-10,12-13,17H,5-6,11H2,1-2H3,(H,24,26,27,28)
InChIKeyOVSNXVUCPMLTLT-UHFFFAOYSA-N
XLogP4.02
TPSA105.75 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.47
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze 6-methyl-2-[2-[3-(3-methylpyrazin-2-yl)-1,2-oxazol-5-yl]pyrrolidin-1-yl]-N-pyridin-2-ylpyrimidin-4-amine 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

6-methoxy-2-[2-[3-(3-methylpyrazin-2-yl)-1,2-oxazol-5-yl]pyrrolidin-1-yl]-N-pyridin-2-ylpyrimidin-4-amine
CID 69107996
6-methyl-N-pyridin-2-yl-2-[(2S)-2-(3-pyridin-2-yl-1,2-oxazol-5-yl)pyrrolidin-1-yl]pyrimidin-4-amine
CID 15978940
6-methyl-N-pyridin-2-yl-2-[2-(3-pyrimidin-2-yl-1,2-oxazol-5-yl)pyrrolidin-1-yl]pyrimidin-4-amine
CID 69107940
6-[[6-methyl-2-[2-[3-(3-methylpyrazin-2-yl)-1,2-oxazol-5-yl]pyrrolidin-1-yl]pyrimidin-4-yl]amino]pyridine-3-carbonitrile
CID 69107978
6-methyl-N-(5-methyl-1H-pyrazol-3-yl)-2-[(2S)-2-(3-pyridin-2-yl-1,2-oxazol-5-yl)pyrrolidin-1-yl]pyrimidin-4-amine
CID 11315620
N-(5-ethyl-1H-pyrazol-3-yl)-6-methyl-2-[2-(3-pyridin-2-yl-1,2-oxazol-5-yl)pyrrolidin-1-yl]pyrimidin-4-amine
CID 68813663
6-(2-methoxyethoxy)-2-[(2S)-2-[3-(3-methylpyrazin-2-yl)-1,2-oxazol-5-yl]pyrrolidin-1-yl]-N-(5-methyl-1H-pyrazol-3-yl)pyrimidin-4-amine
CID 11951842
6-chloro-2-[(2S)-2-[3-(3-methylpyrazin-2-yl)-1,2-oxazol-5-yl]azetidin-1-yl]-N-(5-methyl-1H-pyrazol-3-yl)pyrimidin-4-amine
CID 87748067
2-[[6-methyl-2-[(2S)-2-(3-pyridin-2-yl-1,2-oxazol-5-yl)pyrrolidin-1-yl]pyrimidin-4-yl]amino]-1,3-thiazole-5-carbonitrile
CID 87663042
6-iodo-N-(5-methyl-1H-pyrazol-3-yl)-2-[(2S)-2-(3-pyridin-2-yl-1,2-oxazol-5-yl)pyrrolidin-1-yl]pyrimidin-4-amine
CID 11409698
tert-butyl 2-[[6-methyl-2-[(2S)-2-(3-pyridin-2-yl-1,2-oxazol-5-yl)pyrrolidin-1-yl]pyrimidin-4-yl]amino]imidazole-1-carboxylate
CID 69028208
3-[5-[1-[4-methyl-6-[(5-methyl-1,3-thiazol-2-yl)amino]pyrimidin-2-yl]pyrrolidin-2-yl]-1,2-oxazol-3-yl]pyridine-2-carbonitrile
CID 73231021

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-[2-[3-(3-methylpyrazin-2-yl)-1,2-oxazol-5-yl]pyrrolidin-1-yl]-N-pyridin-2-ylpyrimidin-4-amine?
The IUPAC name of 6-methyl-2-[2-[3-(3-methylpyrazin-2-yl)-1,2-oxazol-5-yl]pyrrolidin-1-yl]-N-pyridin-2-ylpyrimidin-4-amine (CID 69112081) is 6-methyl-2-[2-[3-(3-methylpyrazin-2-yl)-1,2-oxazol-5-yl]pyrrolidin-1-yl]-N-pyridin-2-ylpyrimidin-4-amine.
What is the SMILES notation for 6-methyl-2-[2-[3-(3-methylpyrazin-2-yl)-1,2-oxazol-5-yl]pyrrolidin-1-yl]-N-pyridin-2-ylpyrimidin-4-amine?
The canonical SMILES for 6-methyl-2-[2-[3-(3-methylpyrazin-2-yl)-1,2-oxazol-5-yl]pyrrolidin-1-yl]-N-pyridin-2-ylpyrimidin-4-amine is Cc1cc(Nc2ccccn2)nc(N2CCCC2c2cc(-c3nccnc3C)no2)n1.
What is the InChIKey of 6-methyl-2-[2-[3-(3-methylpyrazin-2-yl)-1,2-oxazol-5-yl]pyrrolidin-1-yl]-N-pyridin-2-ylpyrimidin-4-amine?
The InChIKey is OVSNXVUCPMLTLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N8O/c1-14-12-20(27-19-7-3-4-8-24-19)28-22(26-14)30-11-5-6-17(30)18-13-16(29-31-18)21-15(2)23-9-10-25-21/h3-4,7-10,12-13,17H,5-6,11H2,1-2H3,(H,24,26,27,28).
What are the key properties of 6-methyl-2-[2-[3-(3-methylpyrazin-2-yl)-1,2-oxazol-5-yl]pyrrolidin-1-yl]-N-pyridin-2-ylpyrimidin-4-amine?
6-methyl-2-[2-[3-(3-methylpyrazin-2-yl)-1,2-oxazol-5-yl]pyrrolidin-1-yl]-N-pyridin-2-ylpyrimidin-4-amine has a molecular weight of 414.47 g/mol, XLogP of 4.02, 5 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-[2-[3-(3-methylpyrazin-2-yl)-1,2-oxazol-5-yl]pyrrolidin-1-yl]-N-pyridin-2-ylpyrimidin-4-amine is sourced from PubChem (CID 69112081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).