5-(oxan-2-ylmethoxy)quinazoline-2,4-diamine

C14H18N4O2 — CID 24778297

IUPAC5-(oxan-2-ylmethoxy)quinazoline-2,4-diamine
SMILESNc1nc(N)c2c(OCC3CCCCO3)cccc2n1
InChIInChI=1S/C14H18N4O2/c15-13-12-10(17-14(16)18-13)5-3-6-11(12)20-8-9-4-1-2-7-19-9/h3,5-6,9H,1-2,4,7-8H2,(H4,15,16,17,18)
InChIKeyJSYIXSKCRKYLSI-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.74
Rot. Bonds3

About 5-(oxan-2-ylmethoxy)quinazoline-2,4-diamine

5-(oxan-2-ylmethoxy)quinazoline-2,4-diamine (PubChem CID 24778297) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is 5-(oxan-2-ylmethoxy)quinazoline-2,4-diamine.

Molecular Properties

Compound Name5-(oxan-2-ylmethoxy)quinazoline-2,4-diamine
PubChem CID24778297
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC Name5-(oxan-2-ylmethoxy)quinazoline-2,4-diamine
SMILESNc1nc(N)c2c(OCC3CCCCO3)cccc2n1
InChIInChI=1S/C14H18N4O2/c15-13-12-10(17-14(16)18-13)5-3-6-11(12)20-8-9-4-1-2-7-19-9/h3,5-6,9H,1-2,4,7-8H2,(H4,15,16,17,18)
InChIKeyJSYIXSKCRKYLSI-UHFFFAOYSA-N
XLogP1.74
TPSA96.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 5-(oxan-2-ylmethoxy)quinazoline-2,4-diamine 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

5-[(3-methyl-4,5-dihydro-1,2-oxazol-5-yl)methoxy]quinazoline-2,4-diamine
CID 66924103
2-amino-3-(oxan-2-ylmethoxy)phenol
CID 114764427
5-fluoro-2-[[(2R)-oxan-2-yl]methoxy]aniline
CID 26189643
5-[[(1R,2R,5S)-6,6-dimethyl-2-bicyclo[3.1.1]heptanyl]methoxy]quinazoline-2,4-diamine
CID 66924361
6-(oxan-2-ylmethoxy)pyridine-2,3-diamine
CID 79827597
2-[[(2R)-oxan-2-yl]methoxy]benzonitrile
CID 28602321
4-chloro-2-(oxan-2-ylmethoxy)aniline
CID 62306028
1-[4-[(2,4-diaminoquinazolin-5-yl)oxymethyl]piperidin-1-yl]-2-ethylbutan-1-one
CID 67301583
5-[[1-(piperidin-4-ylmethyl)piperidin-4-yl]methoxy]quinazoline-2,4-diamine
CID 50997768
1-[4-[(2,4-diaminoquinazolin-5-yl)oxymethyl]piperidin-1-yl]-2,2-dimethylpropan-1-one
CID 67302115
5-[[1-(2-fluorophenyl)sulfonylpiperidin-4-yl]methoxy]quinazoline-2,4-diamine
CID 25002763
5-[[1-[(2,5-difluorophenyl)methyl]piperidin-4-yl]methoxy]quinazoline-2,4-diamine
CID 67301832

Frequently Asked Questions

What is the IUPAC name of 5-(oxan-2-ylmethoxy)quinazoline-2,4-diamine?
The IUPAC name of 5-(oxan-2-ylmethoxy)quinazoline-2,4-diamine (CID 24778297) is 5-(oxan-2-ylmethoxy)quinazoline-2,4-diamine.
What is the SMILES notation for 5-(oxan-2-ylmethoxy)quinazoline-2,4-diamine?
The canonical SMILES for 5-(oxan-2-ylmethoxy)quinazoline-2,4-diamine is Nc1nc(N)c2c(OCC3CCCCO3)cccc2n1.
What is the InChIKey of 5-(oxan-2-ylmethoxy)quinazoline-2,4-diamine?
The InChIKey is JSYIXSKCRKYLSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2/c15-13-12-10(17-14(16)18-13)5-3-6-11(12)20-8-9-4-1-2-7-19-9/h3,5-6,9H,1-2,4,7-8H2,(H4,15,16,17,18).
What are the key properties of 5-(oxan-2-ylmethoxy)quinazoline-2,4-diamine?
5-(oxan-2-ylmethoxy)quinazoline-2,4-diamine has a molecular weight of 274.32 g/mol, XLogP of 1.74, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(oxan-2-ylmethoxy)quinazoline-2,4-diamine is sourced from PubChem (CID 24778297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).