6-(2-aminoethoxy)-N-(3-methoxypropyl)-2-methylpyrimidin-4-amine

C11H20N4O2 — CID 121206105

IUPAC6-(2-aminoethoxy)-N-(3-methoxypropyl)-2-methylpyrimidin-4-amine
SMILESCOCCCNc1cc(OCCN)nc(C)n1
InChIInChI=1S/C11H20N4O2/c1-9-14-10(13-5-3-6-16-2)8-11(15-9)17-7-4-12/h8H,3-7,12H2,1-2H3,(H,13,14,15)
InChIKeyLQPHLJCMODUQKU-UHFFFAOYSA-N
MW240.31 g/mol
LogP0.57
Rot. Bonds8

About 6-(2-aminoethoxy)-N-(3-methoxypropyl)-2-methylpyrimidin-4-amine

6-(2-aminoethoxy)-N-(3-methoxypropyl)-2-methylpyrimidin-4-amine (PubChem CID 121206105) has the molecular formula C11H20N4O2 and a molecular weight of 240.31 g/mol. Its IUPAC name is 6-(2-aminoethoxy)-N-(3-methoxypropyl)-2-methylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(2-aminoethoxy)-N-(3-methoxypropyl)-2-methylpyrimidin-4-amine
PubChem CID121206105
Molecular FormulaC11H20N4O2
Molecular Weight240.31 g/mol
Exact Mass240.16
IUPAC Name6-(2-aminoethoxy)-N-(3-methoxypropyl)-2-methylpyrimidin-4-amine
SMILESCOCCCNc1cc(OCCN)nc(C)n1
InChIInChI=1S/C11H20N4O2/c1-9-14-10(13-5-3-6-16-2)8-11(15-9)17-7-4-12/h8H,3-7,12H2,1-2H3,(H,13,14,15)
InChIKeyLQPHLJCMODUQKU-UHFFFAOYSA-N
XLogP0.57
TPSA82.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 6-(2-aminoethoxy)-N-(3-methoxypropyl)-2-methylpyrimidin-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-(2-aminoethoxy)-N-ethyl-2-methylpyrimidin-4-amine
CID 121206106
2-methyl-6-propoxy-N-propylpyrimidin-4-amine
CID 80866216
N-butyl-6-ethoxy-2-methylpyrimidin-4-amine
CID 66327506
N',N'-diethyl-N-[6-(2-methoxyethoxy)-2-methylpyrimidin-4-yl]ethane-1,2-diamine
CID 82454422
6-heptoxy-2-methyl-N-propylpyrimidin-4-amine
CID 80862052
N',N'-dimethyl-N-(2-methyl-6-propoxypyrimidin-4-yl)propane-1,3-diamine
CID 82454010
6-butoxy-N-(3-methoxypropyl)-2-propylpyrimidin-4-amine
CID 82454415
6-butoxy-2-tert-butyl-N-(3-methoxypropyl)pyrimidin-4-amine
CID 82456921
4-N-(3,5-dimethylphenyl)-6-N-(3-methoxypropyl)-2-methylpyrimidine-4,6-diamine
CID 112869720
2-(2-aminoethoxy)-6-[2-(dimethylamino)ethoxy]-N-(2-methoxyethyl)pyrimidin-4-amine
CID 44577491
N-[3-(4-aminocyclohexyl)oxypropyl]-6-methoxy-2-methylpyrimidin-4-amine
CID 66331858
4-N-butan-2-yl-6-N-(3-methoxypropyl)-2-methylpyrimidine-4,6-diamine
CID 112868226

Frequently Asked Questions

What is the IUPAC name of 6-(2-aminoethoxy)-N-(3-methoxypropyl)-2-methylpyrimidin-4-amine?
The IUPAC name of 6-(2-aminoethoxy)-N-(3-methoxypropyl)-2-methylpyrimidin-4-amine (CID 121206105) is 6-(2-aminoethoxy)-N-(3-methoxypropyl)-2-methylpyrimidin-4-amine.
What is the SMILES notation for 6-(2-aminoethoxy)-N-(3-methoxypropyl)-2-methylpyrimidin-4-amine?
The canonical SMILES for 6-(2-aminoethoxy)-N-(3-methoxypropyl)-2-methylpyrimidin-4-amine is COCCCNc1cc(OCCN)nc(C)n1.
What is the InChIKey of 6-(2-aminoethoxy)-N-(3-methoxypropyl)-2-methylpyrimidin-4-amine?
The InChIKey is LQPHLJCMODUQKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O2/c1-9-14-10(13-5-3-6-16-2)8-11(15-9)17-7-4-12/h8H,3-7,12H2,1-2H3,(H,13,14,15).
What are the key properties of 6-(2-aminoethoxy)-N-(3-methoxypropyl)-2-methylpyrimidin-4-amine?
6-(2-aminoethoxy)-N-(3-methoxypropyl)-2-methylpyrimidin-4-amine has a molecular weight of 240.31 g/mol, XLogP of 0.57, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-aminoethoxy)-N-(3-methoxypropyl)-2-methylpyrimidin-4-amine is sourced from PubChem (CID 121206105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).