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

C16H25N5 — CID 80992240

IUPAC2-ethyl-5-methyl-N-propyl-6-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-4-amine
SMILESCCCNc1nc(CC)nc(-n2nc(C)c(C)c2C)c1C
InChIInChI=1S/C16H25N5/c1-7-9-17-15-11(4)16(19-14(8-2)18-15)21-13(6)10(3)12(5)20-21/h7-9H2,1-6H3,(H,17,18,19)
InChIKeyPERFRZRUJBBPAS-UHFFFAOYSA-N
MW287.41 g/mol
LogP3.28
Rot. Bonds5

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

2-ethyl-5-methyl-N-propyl-6-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-4-amine (PubChem CID 80992240) has the molecular formula C16H25N5 and a molecular weight of 287.41 g/mol. Its IUPAC name is 2-ethyl-5-methyl-N-propyl-6-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-ethyl-5-methyl-N-propyl-6-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-4-amine
PubChem CID80992240
Molecular FormulaC16H25N5
Molecular Weight287.41 g/mol
Exact Mass287.21
IUPAC Name2-ethyl-5-methyl-N-propyl-6-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-4-amine
SMILESCCCNc1nc(CC)nc(-n2nc(C)c(C)c2C)c1C
InChIInChI=1S/C16H25N5/c1-7-9-17-15-11(4)16(19-14(8-2)18-15)21-13(6)10(3)12(5)20-21/h7-9H2,1-6H3,(H,17,18,19)
InChIKeyPERFRZRUJBBPAS-UHFFFAOYSA-N
XLogP3.28
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 ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-5-methyl-2-propyl-6-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-4-amine
CID 80992607
2-ethyl-N-propyl-6-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-4-amine
CID 80942222
6-N,2-diethyl-5-methyl-4-N-propylpyrimidine-4,6-diamine
CID 80980725
2-ethyl-6-N,5-dimethyl-4-N-propylpyrimidine-4,6-diamine
CID 80982045
4-[2-ethyl-5-methyl-6-(propylamino)pyrimidin-4-yl]piperazine-2,6-dione
CID 80992565
6-(3,5-dimethyl-1,2,4-triazol-1-yl)-N,2-diethyl-5-methylpyrimidin-4-amine
CID 80992528
2-ethyl-4-N-[2-[ethyl(methyl)amino]ethyl]-5-methyl-6-N-propylpyrimidine-4,6-diamine
CID 80983333
2,5-diethyl-6-methyl-N-propylpyrimidin-4-amine
CID 62191968
6-(3,5-dimethylpyrazol-1-yl)-2,5-dimethyl-N-propylpyrimidin-4-amine
CID 80852866
2-ethyl-5-methyl-6-(2-propan-2-ylpyrrolidin-1-yl)-N-propylpyrimidin-4-amine
CID 80992555
6-(2-ethylimidazol-1-yl)-5-methyl-N,2-dipropylpyrimidin-4-amine
CID 80991668
4-N-(2,2-difluoroethyl)-2-ethyl-5-methyl-6-N-propylpyrimidine-4,6-diamine
CID 113304250

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5-methyl-N-propyl-6-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-4-amine?
The IUPAC name of 2-ethyl-5-methyl-N-propyl-6-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-4-amine (CID 80992240) is 2-ethyl-5-methyl-N-propyl-6-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-4-amine.
What is the SMILES notation for 2-ethyl-5-methyl-N-propyl-6-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-4-amine?
The canonical SMILES for 2-ethyl-5-methyl-N-propyl-6-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-4-amine is CCCNc1nc(CC)nc(-n2nc(C)c(C)c2C)c1C.
What is the InChIKey of 2-ethyl-5-methyl-N-propyl-6-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-4-amine?
The InChIKey is PERFRZRUJBBPAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N5/c1-7-9-17-15-11(4)16(19-14(8-2)18-15)21-13(6)10(3)12(5)20-21/h7-9H2,1-6H3,(H,17,18,19).
What are the key properties of 2-ethyl-5-methyl-N-propyl-6-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-4-amine?
2-ethyl-5-methyl-N-propyl-6-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-4-amine has a molecular weight of 287.41 g/mol, XLogP of 3.28, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5-methyl-N-propyl-6-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-4-amine is sourced from PubChem (CID 80992240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).