3-ethyl-1-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-2-ol

C15H28N4O — CID 106288887

IUPAC3-ethyl-1-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-2-ol
SMILESCCc1nc(NC)c(C)c(NCC(O)C(CC)CC)n1
InChIInChI=1S/C15H28N4O/c1-6-11(7-2)12(20)9-17-15-10(4)14(16-5)18-13(8-3)19-15/h11-12,20H,6-9H2,1-5H3,(H2,16,17,18,19)
InChIKeyRUWNXQICDBAORJ-UHFFFAOYSA-N
MW280.42 g/mol
LogP2.60
Rot. Bonds8

About 3-ethyl-1-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-2-ol

3-ethyl-1-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-2-ol (PubChem CID 106288887) has the molecular formula C15H28N4O and a molecular weight of 280.42 g/mol. Its IUPAC name is 3-ethyl-1-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-2-ol.

Molecular Properties

Compound Name3-ethyl-1-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-2-ol
PubChem CID106288887
Molecular FormulaC15H28N4O
Molecular Weight280.42 g/mol
Exact Mass280.23
IUPAC Name3-ethyl-1-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-2-ol
SMILESCCc1nc(NC)c(C)c(NCC(O)C(CC)CC)n1
InChIInChI=1S/C15H28N4O/c1-6-11(7-2)12(20)9-17-15-10(4)14(16-5)18-13(8-3)19-15/h11-12,20H,6-9H2,1-5H3,(H2,16,17,18,19)
InChIKeyRUWNXQICDBAORJ-UHFFFAOYSA-N
XLogP2.60
TPSA70.07 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 52.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 3-ethyl-1-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-2-ol 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

4-N-(2,2-dicyclopropylethyl)-2-ethyl-6-N,5-dimethylpyrimidine-4,6-diamine
CID 80992371
2-ethyl-6-N,5-dimethyl-4-N-propylpyrimidine-4,6-diamine
CID 80982045
2-ethyl-6-N,5-dimethyl-4-N-(2,2,2-trifluoroethyl)pyrimidine-4,6-diamine
CID 80981203
[1-[[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]methyl]cyclopentyl]methanol
CID 115366345
4-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]-3,3-dimethylbutan-1-ol
CID 106149725
1-[[2-ethyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-4,4-dimethylpentan-2-ol
CID 107159606
3-ethyl-1-[[6-(methylamino)-5-propan-2-ylpyrimidin-4-yl]amino]pentan-2-ol
CID 106288894
3-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]-N,2,2-trimethylpropanamide
CID 106280710
6-(2,2-dimethylhydrazinyl)-2-ethyl-N,5-dimethylpyrimidin-4-amine
CID 83026946
3-[2-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]ethyl]-1,1-dimethylurea
CID 83118046
1-[[2-ethyl-5-methyl-6-(propylamino)pyrimidin-4-yl]amino]-4-methylpentan-2-ol
CID 107159660
3-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]butan-1-ol
CID 83179481

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-2-ol?
The IUPAC name of 3-ethyl-1-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-2-ol (CID 106288887) is 3-ethyl-1-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-2-ol.
What is the SMILES notation for 3-ethyl-1-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-2-ol?
The canonical SMILES for 3-ethyl-1-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-2-ol is CCc1nc(NC)c(C)c(NCC(O)C(CC)CC)n1.
What is the InChIKey of 3-ethyl-1-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-2-ol?
The InChIKey is RUWNXQICDBAORJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4O/c1-6-11(7-2)12(20)9-17-15-10(4)14(16-5)18-13(8-3)19-15/h11-12,20H,6-9H2,1-5H3,(H2,16,17,18,19).
What are the key properties of 3-ethyl-1-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-2-ol?
3-ethyl-1-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-2-ol has a molecular weight of 280.42 g/mol, XLogP of 2.60, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-2-ol is sourced from PubChem (CID 106288887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).