N-ethyl-5-methyl-6-(2-methylpropoxy)-2-propylpyrimidin-4-amine

C14H25N3O — CID 80988348

IUPACN-ethyl-5-methyl-6-(2-methylpropoxy)-2-propylpyrimidin-4-amine
SMILESCCCc1nc(NCC)c(C)c(OCC(C)C)n1
InChIInChI=1S/C14H25N3O/c1-6-8-12-16-13(15-7-2)11(5)14(17-12)18-9-10(3)4/h10H,6-9H2,1-5H3,(H,15,16,17)
InChIKeyAAXMVFPOWRIORF-UHFFFAOYSA-N
MW251.37 g/mol
LogP3.20
Rot. Bonds7

About N-ethyl-5-methyl-6-(2-methylpropoxy)-2-propylpyrimidin-4-amine

N-ethyl-5-methyl-6-(2-methylpropoxy)-2-propylpyrimidin-4-amine (PubChem CID 80988348) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is N-ethyl-5-methyl-6-(2-methylpropoxy)-2-propylpyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-5-methyl-6-(2-methylpropoxy)-2-propylpyrimidin-4-amine
PubChem CID80988348
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC NameN-ethyl-5-methyl-6-(2-methylpropoxy)-2-propylpyrimidin-4-amine
SMILESCCCc1nc(NCC)c(C)c(OCC(C)C)n1
InChIInChI=1S/C14H25N3O/c1-6-8-12-16-13(15-7-2)11(5)14(17-12)18-9-10(3)4/h10H,6-9H2,1-5H3,(H,15,16,17)
InChIKeyAAXMVFPOWRIORF-UHFFFAOYSA-N
XLogP3.20
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-ethyl-5-methyl-6-(2-methylpropoxy)-2-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

N-ethyl-5-methyl-6-[2-(2-methylpropoxy)ethoxy]-2-propylpyrimidin-4-amine
CID 106451466
N-ethyl-6-(3-methoxypropoxy)-5-methyl-2-propylpyrimidin-4-amine
CID 80988992
5-methyl-6-(3-methylbutoxy)-N,2-dipropylpyrimidin-4-amine
CID 80989305
3-[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]oxypropan-1-ol
CID 80988731
4-N-tert-butyl-6-(2-methylpropoxy)-2-propylpyrimidine-4,5-diamine
CID 82456109
6-[3-(dimethylamino)propoxy]-N-ethyl-5-methyl-2-propylpyrimidin-4-amine
CID 80990365
5-methyl-6-(2-propan-2-yloxyethoxy)-N,2-dipropylpyrimidin-4-amine
CID 80988691
N,2-diethyl-5-methyl-6-propoxypyrimidin-4-amine
CID 80989328
4-N-ethyl-6-(2-methylpropoxy)-2-(2-methylpropyl)pyrimidine-4,5-diamine
CID 82458307
5-methyl-6-(4-methylpentan-2-yloxy)-N,2-dipropylpyrimidin-4-amine
CID 80989176
4-N-(1-ethoxypropan-2-yl)-6-N-ethyl-5-methyl-2-propylpyrimidine-4,6-diamine
CID 80983313
2-[5-methyl-2-propyl-6-(propylamino)pyrimidin-4-yl]oxyethanol
CID 80989648

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-methyl-6-(2-methylpropoxy)-2-propylpyrimidin-4-amine?
The IUPAC name of N-ethyl-5-methyl-6-(2-methylpropoxy)-2-propylpyrimidin-4-amine (CID 80988348) is N-ethyl-5-methyl-6-(2-methylpropoxy)-2-propylpyrimidin-4-amine.
What is the SMILES notation for N-ethyl-5-methyl-6-(2-methylpropoxy)-2-propylpyrimidin-4-amine?
The canonical SMILES for N-ethyl-5-methyl-6-(2-methylpropoxy)-2-propylpyrimidin-4-amine is CCCc1nc(NCC)c(C)c(OCC(C)C)n1.
What is the InChIKey of N-ethyl-5-methyl-6-(2-methylpropoxy)-2-propylpyrimidin-4-amine?
The InChIKey is AAXMVFPOWRIORF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-6-8-12-16-13(15-7-2)11(5)14(17-12)18-9-10(3)4/h10H,6-9H2,1-5H3,(H,15,16,17).
What are the key properties of N-ethyl-5-methyl-6-(2-methylpropoxy)-2-propylpyrimidin-4-amine?
N-ethyl-5-methyl-6-(2-methylpropoxy)-2-propylpyrimidin-4-amine has a molecular weight of 251.37 g/mol, XLogP of 3.20, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-methyl-6-(2-methylpropoxy)-2-propylpyrimidin-4-amine is sourced from PubChem (CID 80988348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).