6-ethyl-5-methyl-N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine

C16H25N5 — CID 63560066

IUPAC6-ethyl-5-methyl-N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine
SMILESCCCNc1nc(-c2c(C)nn(C)c2C)nc(CC)c1C
InChIInChI=1S/C16H25N5/c1-7-9-17-15-10(3)13(8-2)18-16(19-15)14-11(4)20-21(6)12(14)5/h7-9H2,1-6H3,(H,17,18,19)
InChIKeyNUHRDRCHZHZXIB-UHFFFAOYSA-N
MW287.41 g/mol
LogP3.19
Rot. Bonds5

About 6-ethyl-5-methyl-N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine

6-ethyl-5-methyl-N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine (PubChem CID 63560066) has the molecular formula C16H25N5 and a molecular weight of 287.41 g/mol. Its IUPAC name is 6-ethyl-5-methyl-N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-ethyl-5-methyl-N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine
PubChem CID63560066
Molecular FormulaC16H25N5
Molecular Weight287.41 g/mol
Exact Mass287.21
IUPAC Name6-ethyl-5-methyl-N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine
SMILESCCCNc1nc(-c2c(C)nn(C)c2C)nc(CC)c1C
InChIInChI=1S/C16H25N5/c1-7-9-17-15-10(3)13(8-2)18-16(19-15)14-11(4)20-21(6)12(14)5/h7-9H2,1-6H3,(H,17,18,19)
InChIKeyNUHRDRCHZHZXIB-UHFFFAOYSA-N
XLogP3.19
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-ethyl-6-methyl-N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine
CID 62203983
N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)-7H-purin-6-amine
CID 117079518
6-ethyl-2-(3-ethyl-1-methylpyrazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine
CID 115990752
6-ethyl-2-(3-ethylimidazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine
CID 66132810
6-ethyl-5-methyl-2-(4-methylphenyl)-N-propylpyrimidin-4-amine
CID 63561195
N-ethyl-5-iodo-6-(methoxymethyl)-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine
CID 66295855
6-ethyl-5-methyl-N-propyl-2-(1H-1,2,4-triazol-5-yl)pyrimidin-4-amine
CID 63560813
6-ethyl-5-methyl-2-(3-methylfuran-2-yl)-N-propylpyrimidin-4-amine
CID 104806725
5-fluoro-N,6-dimethyl-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine
CID 66000415
5-propyl-3-(1,3,5-trimethylpyrazol-4-yl)-1H-1,2,4-triazole
CID 61338679
9-propan-2-yl-N-propyl-8-(1,3,5-trimethylpyrazol-4-yl)purin-6-amine
CID 117090334
N,6-diethyl-5-methyl-2-(3-methylimidazol-4-yl)pyrimidin-4-amine
CID 66117684

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-5-methyl-N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine?
The IUPAC name of 6-ethyl-5-methyl-N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine (CID 63560066) is 6-ethyl-5-methyl-N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine.
What is the SMILES notation for 6-ethyl-5-methyl-N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine?
The canonical SMILES for 6-ethyl-5-methyl-N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine is CCCNc1nc(-c2c(C)nn(C)c2C)nc(CC)c1C.
What is the InChIKey of 6-ethyl-5-methyl-N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine?
The InChIKey is NUHRDRCHZHZXIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N5/c1-7-9-17-15-10(3)13(8-2)18-16(19-15)14-11(4)20-21(6)12(14)5/h7-9H2,1-6H3,(H,17,18,19).
What are the key properties of 6-ethyl-5-methyl-N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine?
6-ethyl-5-methyl-N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine has a molecular weight of 287.41 g/mol, XLogP of 3.19, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-5-methyl-N-propyl-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine is sourced from PubChem (CID 63560066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).