6-(3,5-diethyl-1,2,4-triazol-1-yl)-5-ethyl-N-propylpyrimidin-4-amine

C15H24N6 — CID 80843439

IUPAC6-(3,5-diethyl-1,2,4-triazol-1-yl)-5-ethyl-N-propylpyrimidin-4-amine
SMILESCCCNc1ncnc(-n2nc(CC)nc2CC)c1CC
InChIInChI=1S/C15H24N6/c1-5-9-16-14-11(6-2)15(18-10-17-14)21-13(8-4)19-12(7-3)20-21/h10H,5-9H2,1-4H3,(H,16,17,18)
InChIKeyVVWLRWDTWLUNET-UHFFFAOYSA-N
MW288.40 g/mol
LogP2.57
Rot. Bonds7

About 6-(3,5-diethyl-1,2,4-triazol-1-yl)-5-ethyl-N-propylpyrimidin-4-amine

6-(3,5-diethyl-1,2,4-triazol-1-yl)-5-ethyl-N-propylpyrimidin-4-amine (PubChem CID 80843439) has the molecular formula C15H24N6 and a molecular weight of 288.40 g/mol. Its IUPAC name is 6-(3,5-diethyl-1,2,4-triazol-1-yl)-5-ethyl-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(3,5-diethyl-1,2,4-triazol-1-yl)-5-ethyl-N-propylpyrimidin-4-amine
PubChem CID80843439
Molecular FormulaC15H24N6
Molecular Weight288.40 g/mol
Exact Mass288.21
IUPAC Name6-(3,5-diethyl-1,2,4-triazol-1-yl)-5-ethyl-N-propylpyrimidin-4-amine
SMILESCCCNc1ncnc(-n2nc(CC)nc2CC)c1CC
InChIInChI=1S/C15H24N6/c1-5-9-16-14-11(6-2)15(18-10-17-14)21-13(8-4)19-12(7-3)20-21/h10H,5-9H2,1-4H3,(H,16,17,18)
InChIKeyVVWLRWDTWLUNET-UHFFFAOYSA-N
XLogP2.57
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.40
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-(3,5-diethyl-1,2,4-triazol-1-yl)-5-ethyl-N-propylpyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-(3,5-diethyl-1,2,4-triazol-1-yl)-N,5-diethylpyrimidin-4-amine
CID 80867775
6-(3,5-diethyl-1,2,4-triazol-1-yl)-5-ethyl-N-methylpyrimidin-4-amine
CID 80867685
6-(3,5-dimethyl-1,2,4-triazol-1-yl)-N,5-dipropylpyrimidin-4-amine
CID 80857697
5-ethyl-N-propyl-6-(2-propylimidazol-1-yl)pyrimidin-4-amine
CID 80868806
5-ethyl-6-(2-propan-2-ylpyrrolidin-1-yl)-N-propylpyrimidin-4-amine
CID 80855516
5-ethyl-6-(2-ethylpyrrolidin-1-yl)-N-propylpyrimidin-4-amine
CID 80797289
4-N-(2,2-dimethylpropyl)-5-ethyl-6-N-propylpyrimidine-4,6-diamine
CID 80797563
1-[1-[5-ethyl-6-(propylamino)pyrimidin-4-yl]pyrrolidin-3-yl]ethanol
CID 115967433
5-ethyl-N-propyl-6-(1,4-thiazepan-4-yl)pyrimidin-4-amine
CID 80796184
6-(2,3-dimethylpiperidin-1-yl)-5-ethyl-N-propylpyrimidin-4-amine
CID 80822466
6-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-5-ethyl-N-propylpyrimidin-4-amine
CID 80826867
5-ethyl-6-(4-methylazepan-1-yl)-N-propylpyrimidin-4-amine
CID 80833890

Frequently Asked Questions

What is the IUPAC name of 6-(3,5-diethyl-1,2,4-triazol-1-yl)-5-ethyl-N-propylpyrimidin-4-amine?
The IUPAC name of 6-(3,5-diethyl-1,2,4-triazol-1-yl)-5-ethyl-N-propylpyrimidin-4-amine (CID 80843439) is 6-(3,5-diethyl-1,2,4-triazol-1-yl)-5-ethyl-N-propylpyrimidin-4-amine.
What is the SMILES notation for 6-(3,5-diethyl-1,2,4-triazol-1-yl)-5-ethyl-N-propylpyrimidin-4-amine?
The canonical SMILES for 6-(3,5-diethyl-1,2,4-triazol-1-yl)-5-ethyl-N-propylpyrimidin-4-amine is CCCNc1ncnc(-n2nc(CC)nc2CC)c1CC.
What is the InChIKey of 6-(3,5-diethyl-1,2,4-triazol-1-yl)-5-ethyl-N-propylpyrimidin-4-amine?
The InChIKey is VVWLRWDTWLUNET-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N6/c1-5-9-16-14-11(6-2)15(18-10-17-14)21-13(8-4)19-12(7-3)20-21/h10H,5-9H2,1-4H3,(H,16,17,18).
What are the key properties of 6-(3,5-diethyl-1,2,4-triazol-1-yl)-5-ethyl-N-propylpyrimidin-4-amine?
6-(3,5-diethyl-1,2,4-triazol-1-yl)-5-ethyl-N-propylpyrimidin-4-amine has a molecular weight of 288.40 g/mol, XLogP of 2.57, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,5-diethyl-1,2,4-triazol-1-yl)-5-ethyl-N-propylpyrimidin-4-amine is sourced from PubChem (CID 80843439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).