4-methyl-6-[(2S)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]pyrimidin-2-amine

C15H22N6 — CID 95764333

IUPAC4-methyl-6-[(2S)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]pyrimidin-2-amine
SMILESCc1cc(N2CCC[C@H]2c2c(C)nn(C)c2C)nc(N)n1
InChIInChI=1S/C15H22N6/c1-9-8-13(18-15(16)17-9)21-7-5-6-12(21)14-10(2)19-20(4)11(14)3/h8,12H,5-7H2,1-4H3,(H2,16,17,18)/t12-/m0/s1
InChIKeyPGWSRYMPNZOCRU-LBPRGKRZSA-N
MW286.38 g/mol
LogP2.06
Rot. Bonds2

About 4-methyl-6-[(2S)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]pyrimidin-2-amine

4-methyl-6-[(2S)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]pyrimidin-2-amine (PubChem CID 95764333) has the molecular formula C15H22N6 and a molecular weight of 286.38 g/mol. Its IUPAC name is 4-methyl-6-[(2S)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]pyrimidin-2-amine.

Molecular Properties

Compound Name4-methyl-6-[(2S)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]pyrimidin-2-amine
PubChem CID95764333
Molecular FormulaC15H22N6
Molecular Weight286.38 g/mol
Exact Mass286.19
IUPAC Name4-methyl-6-[(2S)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]pyrimidin-2-amine
SMILESCc1cc(N2CCC[C@H]2c2c(C)nn(C)c2C)nc(N)n1
InChIInChI=1S/C15H22N6/c1-9-8-13(18-15(16)17-9)21-7-5-6-12(21)14-10(2)19-20(4)11(14)3/h8,12H,5-7H2,1-4H3,(H2,16,17,18)/t12-/m0/s1
InChIKeyPGWSRYMPNZOCRU-LBPRGKRZSA-N
XLogP2.06
TPSA72.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-methyl-6-[(2S)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]pyrimidin-2-amine with MolForge

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Related Compounds

2-ethyl-4-methyl-6-[(2R)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]pyrimidine
CID 100759697
2-ethyl-4-methyl-6-[(2S)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]pyrimidine
CID 100759703
4-methyl-6-[2-(4-methyl-1H-pyrazol-5-yl)pyrrolidin-1-yl]pyrimidin-2-amine
CID 110272281
4-(2-cyclopentylpyrrolidin-1-yl)-6-methylpyrimidin-2-amine
CID 47299157
4-methyl-6-[2-(2-methylphenyl)azepan-1-yl]pyrimidin-2-amine
CID 146215377
5-bromo-2-[2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]pyrimidine
CID 75420221
4-[(2R)-2-(2-methoxyphenyl)azepan-1-yl]-6-methylpyrimidin-2-amine
CID 146193903
[1-(2-amino-6-methylpyrimidin-4-yl)piperidin-2-yl]methanol
CID 112726024
4-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)-6-methylpyrimidin-2-amine
CID 78989317
3-[(2S)-1-(2-amino-6-methylpyrimidin-4-yl)azepan-2-yl]-4-methoxyphenol
CID 146214854
3-[(2R)-1-(2-amino-6-methylpyrimidin-4-yl)azepan-2-yl]-4-methoxyphenol
CID 146193661
4-[(2R)-2-(2-chloro-5-methoxyphenyl)azepan-1-yl]-6-methylpyrimidin-2-amine
CID 146193610

Frequently Asked Questions

What is the IUPAC name of 4-methyl-6-[(2S)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]pyrimidin-2-amine?
The IUPAC name of 4-methyl-6-[(2S)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]pyrimidin-2-amine (CID 95764333) is 4-methyl-6-[(2S)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]pyrimidin-2-amine.
What is the SMILES notation for 4-methyl-6-[(2S)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]pyrimidin-2-amine?
The canonical SMILES for 4-methyl-6-[(2S)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]pyrimidin-2-amine is Cc1cc(N2CCC[C@H]2c2c(C)nn(C)c2C)nc(N)n1.
What is the InChIKey of 4-methyl-6-[(2S)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]pyrimidin-2-amine?
The InChIKey is PGWSRYMPNZOCRU-LBPRGKRZSA-N. The full InChI is InChI=1S/C15H22N6/c1-9-8-13(18-15(16)17-9)21-7-5-6-12(21)14-10(2)19-20(4)11(14)3/h8,12H,5-7H2,1-4H3,(H2,16,17,18)/t12-/m0/s1.
What are the key properties of 4-methyl-6-[(2S)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]pyrimidin-2-amine?
4-methyl-6-[(2S)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]pyrimidin-2-amine has a molecular weight of 286.38 g/mol, XLogP of 2.06, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-[(2S)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]pyrimidin-2-amine is sourced from PubChem (CID 95764333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).