N,2-dimethyl-6-[(2S)-1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]pyrimidin-4-amine

C15H22N6 — CID 125008279

IUPACN,2-dimethyl-6-[(2S)-1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]pyrimidin-4-amine
SMILESCNc1cc([C@@H]2CCCN2Cc2ccnn2C)nc(C)n1
InChIInChI=1S/C15H22N6/c1-11-18-13(9-15(16-2)19-11)14-5-4-8-21(14)10-12-6-7-17-20(12)3/h6-7,9,14H,4-5,8,10H2,1-3H3,(H,16,18,19)/t14-/m0/s1
InChIKeyUTXKHRKRZSKSOO-AWEZNQCLSA-N
MW286.38 g/mol
LogP1.90
Rot. Bonds4

About N,2-dimethyl-6-[(2S)-1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]pyrimidin-4-amine

N,2-dimethyl-6-[(2S)-1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]pyrimidin-4-amine (PubChem CID 125008279) has the molecular formula C15H22N6 and a molecular weight of 286.38 g/mol. Its IUPAC name is N,2-dimethyl-6-[(2S)-1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]pyrimidin-4-amine.

Molecular Properties

Compound NameN,2-dimethyl-6-[(2S)-1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]pyrimidin-4-amine
PubChem CID125008279
Molecular FormulaC15H22N6
Molecular Weight286.38 g/mol
Exact Mass286.19
IUPAC NameN,2-dimethyl-6-[(2S)-1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]pyrimidin-4-amine
SMILESCNc1cc([C@@H]2CCCN2Cc2ccnn2C)nc(C)n1
InChIInChI=1S/C15H22N6/c1-11-18-13(9-15(16-2)19-11)14-5-4-8-21(14)10-12-6-7-17-20(12)3/h6-7,9,14H,4-5,8,10H2,1-3H3,(H,16,18,19)/t14-/m0/s1
InChIKeyUTXKHRKRZSKSOO-AWEZNQCLSA-N
XLogP1.90
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-[(4-fluorophenyl)methyl]-2-methyl-6-[(2S)-1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]pyridine
CID 95832568
4-[(4-fluorophenyl)methyl]-2-methyl-6-[(2R)-1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]pyridine
CID 95832569
N-methyl-3-[2-methyl-6-[1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]-4-pyridinyl]propanamide
CID 110255752
N,2-dimethyl-6-[1-(oxan-4-ylmethyl)pyrrolidin-2-yl]pyrimidin-4-amine
CID 110113625
6-[(2R)-1-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-N,2-dimethylpyrimidin-4-amine
CID 124989910
4,6-dimethyl-N-[3-[1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]pyrazin-2-yl]pyrimidin-2-amine
CID 110111786
5-[[(2S)-2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]methyl]-1-methylpyrazole
CID 92613045
5-[(2R)-1-[(2-methylpyrazol-3-yl)methyl]piperidin-2-yl]pyrazolo[1,5-a]pyrimidine
CID 125014658
N,2-dimethyl-6-[(2S)-1-pyrimidin-2-ylpyrrolidin-2-yl]pyrimidin-4-amine
CID 124986346
2-methyl-6-[(2S)-1-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-N-pyrazin-2-ylpyrimidin-4-amine
CID 95820587
1-[2-[2-methyl-6-(methylamino)pyrimidin-4-yl]pyrrolidin-1-yl]-4-pyrazol-1-ylbutan-1-one
CID 110119264
N,2-dimethyl-6-[(2S)-1-pyrazin-2-ylpyrrolidin-2-yl]pyrimidin-4-amine
CID 124979116

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-6-[(2S)-1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]pyrimidin-4-amine?
The IUPAC name of N,2-dimethyl-6-[(2S)-1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]pyrimidin-4-amine (CID 125008279) is N,2-dimethyl-6-[(2S)-1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]pyrimidin-4-amine.
What is the SMILES notation for N,2-dimethyl-6-[(2S)-1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]pyrimidin-4-amine?
The canonical SMILES for N,2-dimethyl-6-[(2S)-1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]pyrimidin-4-amine is CNc1cc([C@@H]2CCCN2Cc2ccnn2C)nc(C)n1.
What is the InChIKey of N,2-dimethyl-6-[(2S)-1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]pyrimidin-4-amine?
The InChIKey is UTXKHRKRZSKSOO-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H22N6/c1-11-18-13(9-15(16-2)19-11)14-5-4-8-21(14)10-12-6-7-17-20(12)3/h6-7,9,14H,4-5,8,10H2,1-3H3,(H,16,18,19)/t14-/m0/s1.
What are the key properties of N,2-dimethyl-6-[(2S)-1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]pyrimidin-4-amine?
N,2-dimethyl-6-[(2S)-1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]pyrimidin-4-amine has a molecular weight of 286.38 g/mol, XLogP of 1.90, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-6-[(2S)-1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]pyrimidin-4-amine is sourced from PubChem (CID 125008279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).