(1R)-1-[4-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]pyrimidin-2-yl]ethanol

C16H18N6O2 — CID 10881940

IUPAC(1R)-1-[4-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]pyrimidin-2-yl]ethanol
SMILESC[C@@H](O)c1nccc(N2CCN(c3nc4cccnc4o3)CC2)n1
InChIInChI=1S/C16H18N6O2/c1-11(23)14-17-6-4-13(20-14)21-7-9-22(10-8-21)16-19-12-3-2-5-18-15(12)24-16/h2-6,11,23H,7-10H2,1H3/t11-/m1/s1
InChIKeyBXDMSRZWOUIMQK-LLVKDONJSA-N
MW326.36 g/mol
LogP1.39
Rot. Bonds3

About (1R)-1-[4-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]pyrimidin-2-yl]ethanol

(1R)-1-[4-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]pyrimidin-2-yl]ethanol (PubChem CID 10881940) has the molecular formula C16H18N6O2 and a molecular weight of 326.36 g/mol. Its IUPAC name is (1R)-1-[4-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]pyrimidin-2-yl]ethanol.

Molecular Properties

Compound Name(1R)-1-[4-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]pyrimidin-2-yl]ethanol
PubChem CID10881940
Molecular FormulaC16H18N6O2
Molecular Weight326.36 g/mol
Exact Mass326.15
IUPAC Name(1R)-1-[4-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]pyrimidin-2-yl]ethanol
SMILESC[C@@H](O)c1nccc(N2CCN(c3nc4cccnc4o3)CC2)n1
InChIInChI=1S/C16H18N6O2/c1-11(23)14-17-6-4-13(20-14)21-7-9-22(10-8-21)16-19-12-3-2-5-18-15(12)24-16/h2-6,11,23H,7-10H2,1H3/t11-/m1/s1
InChIKeyBXDMSRZWOUIMQK-LLVKDONJSA-N
XLogP1.39
TPSA91.41 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.36
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze (1R)-1-[4-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]pyrimidin-2-yl]ethanol with MolForge

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Related Compounds

1-[4-(2,6-Dimethyl-4-oxazolo[5,4-c]pyridin-2-yl-piperazin-1-yl)-pyrimidin-2-yl]-ethanol
CID 10904343
1-[4-(4-Oxazolo[5,4-c]pyridin-2-yl-piperazin-1-yl)-pyrimidin-2-yl]-ethanol
CID 10958350
1-[4-(3-Methyl-4-oxazolo[5,4-c]pyridin-2-yl-piperazin-1-yl)-pyrimidin-2-yl]-ethanol
CID 11013235
4-Oxazolo[5,4-b]pyridin-2-yl-1,4-diazabicyclo[3.2.2]nonane
CID 11447932
1-[4-(4-Oxazolo[4,5-b]pyridin-2-yl-piperazin-1-yl)-pyrimidin-2-yl]-ethanol
CID 10980319
1-[4-(4-Benzooxazol-2-yl-piperazin-1-yl)-pyrimidin-2-yl]-ethanol
CID 11045598
1-[4-(4-Oxazolo[4,5-c]pyridin-2-yl-piperazin-1-yl)-pyrimidin-2-yl]-ethanol
CID 11099443
[4-(4-Benzooxazol-2-yl-piperazin-1-yl)-pyrimidin-2-yl]-methanol
CID 11109705
[3-[2-(Furan-2-yl)-1-methylimidazo[4,5-c]pyridin-7-yl]phenyl]-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]methanone
CID 44528228
6'-Amino-N-[2-(4-morpholinyl)oxazolo[5,4-b]pyridin-5-yl][2,3'-bipyridine]-6-carboxamide
CID 118224405
2-(4-propan-2-yloxy-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)-1,3-benzoxazole
CID 49821912
3-[[2-(Furan-2-yl)-1-pentylimidazo[4,5-c]pyridin-4-yl]-methylamino]propan-1-ol
CID 162667050

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[4-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]pyrimidin-2-yl]ethanol?
The IUPAC name of (1R)-1-[4-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]pyrimidin-2-yl]ethanol (CID 10881940) is (1R)-1-[4-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]pyrimidin-2-yl]ethanol.
What is the SMILES notation for (1R)-1-[4-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]pyrimidin-2-yl]ethanol?
The canonical SMILES for (1R)-1-[4-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]pyrimidin-2-yl]ethanol is C[C@@H](O)c1nccc(N2CCN(c3nc4cccnc4o3)CC2)n1.
What is the InChIKey of (1R)-1-[4-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]pyrimidin-2-yl]ethanol?
The InChIKey is BXDMSRZWOUIMQK-LLVKDONJSA-N. The full InChI is InChI=1S/C16H18N6O2/c1-11(23)14-17-6-4-13(20-14)21-7-9-22(10-8-21)16-19-12-3-2-5-18-15(12)24-16/h2-6,11,23H,7-10H2,1H3/t11-/m1/s1.
What are the key properties of (1R)-1-[4-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]pyrimidin-2-yl]ethanol?
(1R)-1-[4-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]pyrimidin-2-yl]ethanol has a molecular weight of 326.36 g/mol, XLogP of 1.39, 3 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[4-[4-([1,3]oxazolo[5,4-b]pyridin-2-yl)piperazin-1-yl]pyrimidin-2-yl]ethanol is sourced from PubChem (CID 10881940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).