2-(3-ethyl-1-methylpyrazol-4-yl)-N-methyl-6-(2-methylpropyl)pyrimidin-4-amine

C15H23N5 — CID 115990831

IUPAC2-(3-ethyl-1-methylpyrazol-4-yl)-N-methyl-6-(2-methylpropyl)pyrimidin-4-amine
SMILESCCc1nn(C)cc1-c1nc(CC(C)C)cc(NC)n1
InChIInChI=1S/C15H23N5/c1-6-13-12(9-20(5)19-13)15-17-11(7-10(2)3)8-14(16-4)18-15/h8-10H,6-7H2,1-5H3,(H,16,17,18)
InChIKeyLNDODTAETAXSNB-UHFFFAOYSA-N
MW273.38 g/mol
LogP2.68
Rot. Bonds5

About 2-(3-ethyl-1-methylpyrazol-4-yl)-N-methyl-6-(2-methylpropyl)pyrimidin-4-amine

2-(3-ethyl-1-methylpyrazol-4-yl)-N-methyl-6-(2-methylpropyl)pyrimidin-4-amine (PubChem CID 115990831) has the molecular formula C15H23N5 and a molecular weight of 273.38 g/mol. Its IUPAC name is 2-(3-ethyl-1-methylpyrazol-4-yl)-N-methyl-6-(2-methylpropyl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-(3-ethyl-1-methylpyrazol-4-yl)-N-methyl-6-(2-methylpropyl)pyrimidin-4-amine
PubChem CID115990831
Molecular FormulaC15H23N5
Molecular Weight273.38 g/mol
Exact Mass273.20
IUPAC Name2-(3-ethyl-1-methylpyrazol-4-yl)-N-methyl-6-(2-methylpropyl)pyrimidin-4-amine
SMILESCCc1nn(C)cc1-c1nc(CC(C)C)cc(NC)n1
InChIInChI=1S/C15H23N5/c1-6-13-12(9-20(5)19-13)15-17-11(7-10(2)3)8-14(16-4)18-15/h8-10H,6-7H2,1-5H3,(H,16,17,18)
InChIKeyLNDODTAETAXSNB-UHFFFAOYSA-N
XLogP2.68
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-6-propan-2-ylpyrimidin-4-amine
CID 115990720
2-(3-tert-butyl-1-methylpyrazol-4-yl)-N-methyl-6-propylpyrimidin-4-amine
CID 83091370
6-ethyl-N-methyl-2-(1-methylpyrazol-4-yl)pyrimidin-4-amine
CID 62201696
2-(1,3-dimethylpyrazol-4-yl)-6-(2-methylpropyl)pyrimidin-4-amine
CID 83094220
2-(3-ethyl-1-methylpyrazol-4-yl)-5-iodo-N,6-dimethylpyrimidin-4-amine
CID 112671008
2-(1,3-dimethylpyrazol-4-yl)-6-ethyl-N-propylpyrimidin-4-amine
CID 83092125
2-(3-ethyl-1-methylpyrazol-4-yl)-N-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 112670983
5-bromo-4,6-dichloro-2-(3-ethyl-1-methylpyrazol-4-yl)pyrimidine
CID 112670214
6-ethyl-N-methyl-2-(2-methylphenyl)pyrimidin-4-amine
CID 62190207
5-bromo-6-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)pyrimidin-4-amine
CID 112671013
5-bromo-4-chloro-2-(3-ethyl-1-methylpyrazol-4-yl)-6-propan-2-ylpyrimidine
CID 112670230
6-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine
CID 115990752

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethyl-1-methylpyrazol-4-yl)-N-methyl-6-(2-methylpropyl)pyrimidin-4-amine?
The IUPAC name of 2-(3-ethyl-1-methylpyrazol-4-yl)-N-methyl-6-(2-methylpropyl)pyrimidin-4-amine (CID 115990831) is 2-(3-ethyl-1-methylpyrazol-4-yl)-N-methyl-6-(2-methylpropyl)pyrimidin-4-amine.
What is the SMILES notation for 2-(3-ethyl-1-methylpyrazol-4-yl)-N-methyl-6-(2-methylpropyl)pyrimidin-4-amine?
The canonical SMILES for 2-(3-ethyl-1-methylpyrazol-4-yl)-N-methyl-6-(2-methylpropyl)pyrimidin-4-amine is CCc1nn(C)cc1-c1nc(CC(C)C)cc(NC)n1.
What is the InChIKey of 2-(3-ethyl-1-methylpyrazol-4-yl)-N-methyl-6-(2-methylpropyl)pyrimidin-4-amine?
The InChIKey is LNDODTAETAXSNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5/c1-6-13-12(9-20(5)19-13)15-17-11(7-10(2)3)8-14(16-4)18-15/h8-10H,6-7H2,1-5H3,(H,16,17,18).
What are the key properties of 2-(3-ethyl-1-methylpyrazol-4-yl)-N-methyl-6-(2-methylpropyl)pyrimidin-4-amine?
2-(3-ethyl-1-methylpyrazol-4-yl)-N-methyl-6-(2-methylpropyl)pyrimidin-4-amine has a molecular weight of 273.38 g/mol, XLogP of 2.68, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethyl-1-methylpyrazol-4-yl)-N-methyl-6-(2-methylpropyl)pyrimidin-4-amine is sourced from PubChem (CID 115990831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).