5-ethyl-6-(2-ethylpyrrolidin-1-yl)-N-propylpyrimidin-4-amine

C15H26N4 — CID 80797289

IUPAC5-ethyl-6-(2-ethylpyrrolidin-1-yl)-N-propylpyrimidin-4-amine
SMILESCCCNc1ncnc(N2CCCC2CC)c1CC
InChIInChI=1S/C15H26N4/c1-4-9-16-14-13(6-3)15(18-11-17-14)19-10-7-8-12(19)5-2/h11-12H,4-10H2,1-3H3,(H,16,17,18)
InChIKeyDNBCWSSWNSCEPZ-UHFFFAOYSA-N
MW262.40 g/mol
LogP3.24
Rot. Bonds6

About 5-ethyl-6-(2-ethylpyrrolidin-1-yl)-N-propylpyrimidin-4-amine

5-ethyl-6-(2-ethylpyrrolidin-1-yl)-N-propylpyrimidin-4-amine (PubChem CID 80797289) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is 5-ethyl-6-(2-ethylpyrrolidin-1-yl)-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name5-ethyl-6-(2-ethylpyrrolidin-1-yl)-N-propylpyrimidin-4-amine
PubChem CID80797289
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC Name5-ethyl-6-(2-ethylpyrrolidin-1-yl)-N-propylpyrimidin-4-amine
SMILESCCCNc1ncnc(N2CCCC2CC)c1CC
InChIInChI=1S/C15H26N4/c1-4-9-16-14-13(6-3)15(18-11-17-14)19-10-7-8-12(19)5-2/h11-12H,4-10H2,1-3H3,(H,16,17,18)
InChIKeyDNBCWSSWNSCEPZ-UHFFFAOYSA-N
XLogP3.24
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(2-ethylpyrrolidin-1-yl)-N,5-dipropylpyrimidin-4-amine
CID 80797402
6-(2-ethylpyrrolidin-1-yl)-5-methyl-N-propylpyrimidin-4-amine
CID 80797292
6-(2,3-dimethylpiperidin-1-yl)-5-ethyl-N-propylpyrimidin-4-amine
CID 80822466
5-ethyl-6-(2-propan-2-ylpyrrolidin-1-yl)-N-propylpyrimidin-4-amine
CID 80855516
6-(2-ethylpyrrolidin-1-yl)-5-nitro-N-propylpyrimidin-4-amine
CID 80793978
1-[5-ethyl-6-(propylamino)pyrimidin-4-yl]-N-methylpyrrolidine-2-carboxamide
CID 80785472
5-ethyl-6-(2-ethylpyrrolidin-1-yl)pyrimidin-4-amine
CID 80797287
6-(2-ethylpyrrolidin-1-yl)-N-methyl-5-propylpyrimidin-4-amine
CID 80791469
6-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-N,5-diethylpyrimidin-4-amine
CID 80825609
6-(2,3-dimethylpiperidin-1-yl)-N,5-dipropylpyrimidin-4-amine
CID 80798586
5-ethyl-6-(4-methylazepan-1-yl)-N-propylpyrimidin-4-amine
CID 80833890
6-(3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl)-5-ethyl-N-propylpyrimidin-4-amine
CID 80791082

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-6-(2-ethylpyrrolidin-1-yl)-N-propylpyrimidin-4-amine?
The IUPAC name of 5-ethyl-6-(2-ethylpyrrolidin-1-yl)-N-propylpyrimidin-4-amine (CID 80797289) is 5-ethyl-6-(2-ethylpyrrolidin-1-yl)-N-propylpyrimidin-4-amine.
What is the SMILES notation for 5-ethyl-6-(2-ethylpyrrolidin-1-yl)-N-propylpyrimidin-4-amine?
The canonical SMILES for 5-ethyl-6-(2-ethylpyrrolidin-1-yl)-N-propylpyrimidin-4-amine is CCCNc1ncnc(N2CCCC2CC)c1CC.
What is the InChIKey of 5-ethyl-6-(2-ethylpyrrolidin-1-yl)-N-propylpyrimidin-4-amine?
The InChIKey is DNBCWSSWNSCEPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-4-9-16-14-13(6-3)15(18-11-17-14)19-10-7-8-12(19)5-2/h11-12H,4-10H2,1-3H3,(H,16,17,18).
What are the key properties of 5-ethyl-6-(2-ethylpyrrolidin-1-yl)-N-propylpyrimidin-4-amine?
5-ethyl-6-(2-ethylpyrrolidin-1-yl)-N-propylpyrimidin-4-amine has a molecular weight of 262.40 g/mol, XLogP of 3.24, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-6-(2-ethylpyrrolidin-1-yl)-N-propylpyrimidin-4-amine is sourced from PubChem (CID 80797289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).