6-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine

C16H25N5 — CID 115990752

IUPAC6-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine
SMILESCCCNc1nc(-c2cn(C)nc2CC)nc(CC)c1C
InChIInChI=1S/C16H25N5/c1-6-9-17-15-11(4)13(7-2)18-16(19-15)12-10-21(5)20-14(12)8-3/h10H,6-9H2,1-5H3,(H,17,18,19)
InChIKeyLCWBOUROEYNPLT-UHFFFAOYSA-N
MW287.41 g/mol
LogP3.13
Rot. Bonds6

About 6-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine

6-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine (PubChem CID 115990752) has the molecular formula C16H25N5 and a molecular weight of 287.41 g/mol. Its IUPAC name is 6-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name6-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine
PubChem CID115990752
Molecular FormulaC16H25N5
Molecular Weight287.41 g/mol
Exact Mass287.21
IUPAC Name6-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine
SMILESCCCNc1nc(-c2cn(C)nc2CC)nc(CC)c1C
InChIInChI=1S/C16H25N5/c1-6-9-17-15-11(4)13(7-2)18-16(19-15)12-10-21(5)20-14(12)8-3/h10H,6-9H2,1-5H3,(H,17,18,19)
InChIKeyLCWBOUROEYNPLT-UHFFFAOYSA-N
XLogP3.13
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-ethyl-5-methyl-N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine
CID 63560066
6-ethyl-5-methyl-2-(4-methylphenyl)-N-propylpyrimidin-4-amine
CID 63561195
6-ethyl-5-methyl-N-propyl-2-(1H-1,2,4-triazol-5-yl)pyrimidin-4-amine
CID 63560813
6-ethyl-2-(3-ethylimidazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine
CID 66132810
2-(3-ethyl-1-methylpyrazol-4-yl)-5-iodo-N,6-dimethylpyrimidin-4-amine
CID 112671008
6-ethyl-5-methyl-2-(3-methylfuran-2-yl)-N-propylpyrimidin-4-amine
CID 104806725
5-bromo-6-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)pyrimidin-4-amine
CID 112671013
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
2-(1,3-dimethylpyrazol-4-yl)-6-ethyl-N-propylpyrimidin-4-amine
CID 83092125
5-bromo-2-(3-tert-butyl-1-methylpyrazol-4-yl)-6-ethyl-N-methylpyrimidin-4-amine
CID 83084574
N-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-6-propan-2-ylpyrimidin-4-amine
CID 115990720

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine?
The IUPAC name of 6-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine (CID 115990752) is 6-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine.
What is the SMILES notation for 6-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine?
The canonical SMILES for 6-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine is CCCNc1nc(-c2cn(C)nc2CC)nc(CC)c1C.
What is the InChIKey of 6-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine?
The InChIKey is LCWBOUROEYNPLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N5/c1-6-9-17-15-11(4)13(7-2)18-16(19-15)12-10-21(5)20-14(12)8-3/h10H,6-9H2,1-5H3,(H,17,18,19).
What are the key properties of 6-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine?
6-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine has a molecular weight of 287.41 g/mol, XLogP of 3.13, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine is sourced from PubChem (CID 115990752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).