5-ethyl-N-propyl-6-(2-propylimidazol-1-yl)pyrimidin-4-amine

C15H23N5 — CID 80868806

IUPAC5-ethyl-N-propyl-6-(2-propylimidazol-1-yl)pyrimidin-4-amine
SMILESCCCNc1ncnc(-n2ccnc2CCC)c1CC
InChIInChI=1S/C15H23N5/c1-4-7-13-16-9-10-20(13)15-12(6-3)14(17-8-5-2)18-11-19-15/h9-11H,4-8H2,1-3H3,(H,17,18,19)
InChIKeyCMQMKODXYALRPJ-UHFFFAOYSA-N
MW273.38 g/mol
LogP3.00
Rot. Bonds7

About 5-ethyl-N-propyl-6-(2-propylimidazol-1-yl)pyrimidin-4-amine

5-ethyl-N-propyl-6-(2-propylimidazol-1-yl)pyrimidin-4-amine (PubChem CID 80868806) has the molecular formula C15H23N5 and a molecular weight of 273.38 g/mol. Its IUPAC name is 5-ethyl-N-propyl-6-(2-propylimidazol-1-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name5-ethyl-N-propyl-6-(2-propylimidazol-1-yl)pyrimidin-4-amine
PubChem CID80868806
Molecular FormulaC15H23N5
Molecular Weight273.38 g/mol
Exact Mass273.20
IUPAC Name5-ethyl-N-propyl-6-(2-propylimidazol-1-yl)pyrimidin-4-amine
SMILESCCCNc1ncnc(-n2ccnc2CCC)c1CC
InChIInChI=1S/C15H23N5/c1-4-7-13-16-9-10-20(13)15-12(6-3)14(17-8-5-2)18-11-19-15/h9-11H,4-8H2,1-3H3,(H,17,18,19)
InChIKeyCMQMKODXYALRPJ-UHFFFAOYSA-N
XLogP3.00
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-methyl-N-propyl-6-(2-propylimidazol-1-yl)pyrimidin-4-amine
CID 80868402
6-(2-ethylimidazol-1-yl)-5-methyl-N,2-dipropylpyrimidin-4-amine
CID 80991668
6-(3,5-diethyl-1,2,4-triazol-1-yl)-5-ethyl-N-propylpyrimidin-4-amine
CID 80843439
5-ethyl-4-N-(2-imidazol-1-ylethyl)-6-N-propylpyrimidine-4,6-diamine
CID 80809603
5-ethyl-6-(2-ethylpyrrolidin-1-yl)-N-propylpyrimidin-4-amine
CID 80797289
5-ethyl-4-N-(2-methylbutan-2-yl)-6-N-propylpyrimidine-4,6-diamine
CID 80768376
[2,5-dimethyl-6-(2-propylimidazol-1-yl)pyrimidin-4-yl]hydrazine
CID 80903201
6-(2-methylimidazol-1-yl)-5-nitro-N-propylpyrimidin-4-amine
CID 80852878
1-[5-ethyl-6-(propylamino)pyrimidin-4-yl]-1,4-diazepan-5-one
CID 80831098
6-hydrazinyl-N-[2-(1-methylimidazol-2-yl)ethyl]-5-propylpyrimidin-4-amine
CID 80908147
4-N-(2,2-dimethylpropyl)-5-ethyl-6-N-propylpyrimidine-4,6-diamine
CID 80797563
6-(2-ethylpyrrolidin-1-yl)-N,5-dipropylpyrimidin-4-amine
CID 80797402

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-propyl-6-(2-propylimidazol-1-yl)pyrimidin-4-amine?
The IUPAC name of 5-ethyl-N-propyl-6-(2-propylimidazol-1-yl)pyrimidin-4-amine (CID 80868806) is 5-ethyl-N-propyl-6-(2-propylimidazol-1-yl)pyrimidin-4-amine.
What is the SMILES notation for 5-ethyl-N-propyl-6-(2-propylimidazol-1-yl)pyrimidin-4-amine?
The canonical SMILES for 5-ethyl-N-propyl-6-(2-propylimidazol-1-yl)pyrimidin-4-amine is CCCNc1ncnc(-n2ccnc2CCC)c1CC.
What is the InChIKey of 5-ethyl-N-propyl-6-(2-propylimidazol-1-yl)pyrimidin-4-amine?
The InChIKey is CMQMKODXYALRPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5/c1-4-7-13-16-9-10-20(13)15-12(6-3)14(17-8-5-2)18-11-19-15/h9-11H,4-8H2,1-3H3,(H,17,18,19).
What are the key properties of 5-ethyl-N-propyl-6-(2-propylimidazol-1-yl)pyrimidin-4-amine?
5-ethyl-N-propyl-6-(2-propylimidazol-1-yl)pyrimidin-4-amine has a molecular weight of 273.38 g/mol, XLogP of 3.00, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-propyl-6-(2-propylimidazol-1-yl)pyrimidin-4-amine is sourced from PubChem (CID 80868806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).