5-(2-methoxyethoxy)quinazoline-2,4-diamine

C11H14N4O2 — CID 11637233

IUPAC5-(2-methoxyethoxy)quinazoline-2,4-diamine
SMILESCOCCOc1cccc2nc(N)nc(N)c12
InChIInChI=1S/C11H14N4O2/c1-16-5-6-17-8-4-2-3-7-9(8)10(12)15-11(13)14-7/h2-4H,5-6H2,1H3,(H4,12,13,14,15)
InChIKeyDEXAUZQLNWCCTO-UHFFFAOYSA-N
MW234.26 g/mol
LogP0.82
Rot. Bonds4

About 5-(2-methoxyethoxy)quinazoline-2,4-diamine

5-(2-methoxyethoxy)quinazoline-2,4-diamine (PubChem CID 11637233) has the molecular formula C11H14N4O2 and a molecular weight of 234.26 g/mol. Its IUPAC name is 5-(2-methoxyethoxy)quinazoline-2,4-diamine.

Molecular Properties

Compound Name5-(2-methoxyethoxy)quinazoline-2,4-diamine
PubChem CID11637233
Molecular FormulaC11H14N4O2
Molecular Weight234.26 g/mol
Exact Mass234.11
IUPAC Name5-(2-methoxyethoxy)quinazoline-2,4-diamine
SMILESCOCCOc1cccc2nc(N)nc(N)c12
InChIInChI=1S/C11H14N4O2/c1-16-5-6-17-8-4-2-3-7-9(8)10(12)15-11(13)14-7/h2-4H,5-6H2,1H3,(H4,12,13,14,15)
InChIKeyDEXAUZQLNWCCTO-UHFFFAOYSA-N
XLogP0.82
TPSA96.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2,5-bis(2-methoxyethoxy)quinazolin-4-amine;methanesulfonic acid
CID 161275522
5-[3-(4-chlorophenyl)propoxy]quinazoline-2,4-diamine
CID 11558965
5-[(3,4-dimethoxyphenyl)methoxy]quinazoline-2,4-diamine
CID 66924159
5-[(2-fluorophenyl)methoxy]quinazoline-2,4-diamine
CID 24778025
5-[2-(4-chlorophenyl)-3-(methoxymethoxy)propoxy]quinazoline-2,4-diamine
CID 11703778
5-phenoxyquinazoline-2,4-diamine
CID 4308266
5-[(3-methyl-4,5-dihydro-1,2-oxazol-5-yl)methoxy]quinazoline-2,4-diamine
CID 66924103
5-(3,4-dimethoxyphenoxy)quinazoline-2,4-diamine
CID 15551242
1-[4-[(2,4-diaminoquinazolin-5-yl)oxymethyl]piperidin-1-yl]-2,2-dimethylpropan-1-one
CID 67302115
5-[[(1R,2R,5S)-6,6-dimethyl-2-bicyclo[3.1.1]heptanyl]methoxy]quinazoline-2,4-diamine
CID 66924361
2-[2-(2,4-diaminoquinazolin-5-yl)oxyphenyl]ethanol
CID 69360131
1-[4-[(2,4-diaminoquinazolin-5-yl)oxymethyl]piperidin-1-yl]-2-ethylbutan-1-one
CID 67301583

Frequently Asked Questions

What is the IUPAC name of 5-(2-methoxyethoxy)quinazoline-2,4-diamine?
The IUPAC name of 5-(2-methoxyethoxy)quinazoline-2,4-diamine (CID 11637233) is 5-(2-methoxyethoxy)quinazoline-2,4-diamine.
What is the SMILES notation for 5-(2-methoxyethoxy)quinazoline-2,4-diamine?
The canonical SMILES for 5-(2-methoxyethoxy)quinazoline-2,4-diamine is COCCOc1cccc2nc(N)nc(N)c12.
What is the InChIKey of 5-(2-methoxyethoxy)quinazoline-2,4-diamine?
The InChIKey is DEXAUZQLNWCCTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O2/c1-16-5-6-17-8-4-2-3-7-9(8)10(12)15-11(13)14-7/h2-4H,5-6H2,1H3,(H4,12,13,14,15).
What are the key properties of 5-(2-methoxyethoxy)quinazoline-2,4-diamine?
5-(2-methoxyethoxy)quinazoline-2,4-diamine has a molecular weight of 234.26 g/mol, XLogP of 0.82, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxyethoxy)quinazoline-2,4-diamine is sourced from PubChem (CID 11637233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).