[4-[(6-amino-2-propylpyrimidin-4-yl)amino]oxan-4-yl]methanol

C13H22N4O2 — CID 106301136

IUPAC[4-[(6-amino-2-propylpyrimidin-4-yl)amino]oxan-4-yl]methanol
SMILESCCCc1nc(N)cc(NC2(CO)CCOCC2)n1
InChIInChI=1S/C13H22N4O2/c1-2-3-11-15-10(14)8-12(16-11)17-13(9-18)4-6-19-7-5-13/h8,18H,2-7,9H2,1H3,(H3,14,15,16,17)
InChIKeyCUAANLOUTIRNAU-UHFFFAOYSA-N
MW266.34 g/mol
LogP0.96
Rot. Bonds5

About [4-[(6-amino-2-propylpyrimidin-4-yl)amino]oxan-4-yl]methanol

[4-[(6-amino-2-propylpyrimidin-4-yl)amino]oxan-4-yl]methanol (PubChem CID 106301136) has the molecular formula C13H22N4O2 and a molecular weight of 266.34 g/mol. Its IUPAC name is [4-[(6-amino-2-propylpyrimidin-4-yl)amino]oxan-4-yl]methanol.

Molecular Properties

Compound Name[4-[(6-amino-2-propylpyrimidin-4-yl)amino]oxan-4-yl]methanol
PubChem CID106301136
Molecular FormulaC13H22N4O2
Molecular Weight266.34 g/mol
Exact Mass266.17
IUPAC Name[4-[(6-amino-2-propylpyrimidin-4-yl)amino]oxan-4-yl]methanol
SMILESCCCc1nc(N)cc(NC2(CO)CCOCC2)n1
InChIInChI=1S/C13H22N4O2/c1-2-3-11-15-10(14)8-12(16-11)17-13(9-18)4-6-19-7-5-13/h8,18H,2-7,9H2,1H3,(H3,14,15,16,17)
InChIKeyCUAANLOUTIRNAU-UHFFFAOYSA-N
XLogP0.96
TPSA93.29 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 50.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze [4-[(6-amino-2-propylpyrimidin-4-yl)amino]oxan-4-yl]methanol with MolForge

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Related Compounds

[1-[(6-amino-2-propylpyrimidin-4-yl)amino]cyclohexyl]methanol
CID 80955109
[4-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]oxan-4-yl]methanol
CID 106301218
[4-[[6-amino-2-(trifluoromethyl)pyrimidin-4-yl]amino]oxan-4-yl]methanol
CID 106301120
[1-[[(6-amino-2-propylpyrimidin-4-yl)amino]methyl]cyclopropyl]methanol
CID 115457185
[4-[(4-amino-6-chloro-2-pyridinyl)amino]oxan-4-yl]methanol
CID 114169989
[4-[(2,6-dimethylpyrimidin-4-yl)amino]oxan-4-yl]methanol
CID 114170393
[4-[(6-chloro-2-methylpyrimidin-4-yl)amino]oxan-4-yl]methanol
CID 106300524
6-hydrazinyl-2-propylpyrimidin-4-amine
CID 80947336
[1-[(6-amino-2-ethylpyrimidin-4-yl)amino]-3-methylcyclohexyl]methanol
CID 80934546
3-[(6-amino-2-propylpyrimidin-4-yl)amino]propan-1-ol
CID 80954273
[4-[[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]oxan-4-yl]methanol
CID 106301181
[4-[(5-amino-2-pyridinyl)amino]oxan-4-yl]methanol
CID 106296826

Frequently Asked Questions

What is the IUPAC name of [4-[(6-amino-2-propylpyrimidin-4-yl)amino]oxan-4-yl]methanol?
The IUPAC name of [4-[(6-amino-2-propylpyrimidin-4-yl)amino]oxan-4-yl]methanol (CID 106301136) is [4-[(6-amino-2-propylpyrimidin-4-yl)amino]oxan-4-yl]methanol.
What is the SMILES notation for [4-[(6-amino-2-propylpyrimidin-4-yl)amino]oxan-4-yl]methanol?
The canonical SMILES for [4-[(6-amino-2-propylpyrimidin-4-yl)amino]oxan-4-yl]methanol is CCCc1nc(N)cc(NC2(CO)CCOCC2)n1.
What is the InChIKey of [4-[(6-amino-2-propylpyrimidin-4-yl)amino]oxan-4-yl]methanol?
The InChIKey is CUAANLOUTIRNAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O2/c1-2-3-11-15-10(14)8-12(16-11)17-13(9-18)4-6-19-7-5-13/h8,18H,2-7,9H2,1H3,(H3,14,15,16,17).
What are the key properties of [4-[(6-amino-2-propylpyrimidin-4-yl)amino]oxan-4-yl]methanol?
[4-[(6-amino-2-propylpyrimidin-4-yl)amino]oxan-4-yl]methanol has a molecular weight of 266.34 g/mol, XLogP of 0.96, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(6-amino-2-propylpyrimidin-4-yl)amino]oxan-4-yl]methanol is sourced from PubChem (CID 106301136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).