2-[[2-[2-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]methyl]-[1,3]oxazolo[4,5-b]pyridine

C15H19N7O3 — CID 155916042

IUPAC2-[[2-[2-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]methyl]-[1,3]oxazolo[4,5-b]pyridine
SMILESCOCCn1nnc(C2CN(Cc3nc4ncccc4o3)CCO2)n1
InChIInChI=1S/C15H19N7O3/c1-23-7-6-22-19-15(18-20-22)12-9-21(5-8-24-12)10-13-17-14-11(25-13)3-2-4-16-14/h2-4,12H,5-10H2,1H3
InChIKeyBCERWCVNPUPJFS-UHFFFAOYSA-N
MW345.36 g/mol
LogP0.43
Rot. Bonds6

About 2-[[2-[2-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]methyl]-[1,3]oxazolo[4,5-b]pyridine

2-[[2-[2-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]methyl]-[1,3]oxazolo[4,5-b]pyridine (PubChem CID 155916042) has the molecular formula C15H19N7O3 and a molecular weight of 345.36 g/mol. Its IUPAC name is 2-[[2-[2-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]methyl]-[1,3]oxazolo[4,5-b]pyridine.

Molecular Properties

Compound Name2-[[2-[2-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]methyl]-[1,3]oxazolo[4,5-b]pyridine
PubChem CID155916042
Molecular FormulaC15H19N7O3
Molecular Weight345.36 g/mol
Exact Mass345.15
IUPAC Name2-[[2-[2-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]methyl]-[1,3]oxazolo[4,5-b]pyridine
SMILESCOCCn1nnc(C2CN(Cc3nc4ncccc4o3)CCO2)n1
InChIInChI=1S/C15H19N7O3/c1-23-7-6-22-19-15(18-20-22)12-9-21(5-8-24-12)10-13-17-14-11(25-13)3-2-4-16-14/h2-4,12H,5-10H2,1H3
InChIKeyBCERWCVNPUPJFS-UHFFFAOYSA-N
XLogP0.43
TPSA104.22 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.36
LogP ≤ 50.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

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Frequently Asked Questions

What is the IUPAC name of 2-[[2-[2-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]methyl]-[1,3]oxazolo[4,5-b]pyridine?
The IUPAC name of 2-[[2-[2-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]methyl]-[1,3]oxazolo[4,5-b]pyridine (CID 155916042) is 2-[[2-[2-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]methyl]-[1,3]oxazolo[4,5-b]pyridine.
What is the SMILES notation for 2-[[2-[2-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]methyl]-[1,3]oxazolo[4,5-b]pyridine?
The canonical SMILES for 2-[[2-[2-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]methyl]-[1,3]oxazolo[4,5-b]pyridine is COCCn1nnc(C2CN(Cc3nc4ncccc4o3)CCO2)n1.
What is the InChIKey of 2-[[2-[2-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]methyl]-[1,3]oxazolo[4,5-b]pyridine?
The InChIKey is BCERWCVNPUPJFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N7O3/c1-23-7-6-22-19-15(18-20-22)12-9-21(5-8-24-12)10-13-17-14-11(25-13)3-2-4-16-14/h2-4,12H,5-10H2,1H3.
What are the key properties of 2-[[2-[2-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]methyl]-[1,3]oxazolo[4,5-b]pyridine?
2-[[2-[2-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]methyl]-[1,3]oxazolo[4,5-b]pyridine has a molecular weight of 345.36 g/mol, XLogP of 0.43, 6 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-[2-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]methyl]-[1,3]oxazolo[4,5-b]pyridine is sourced from PubChem (CID 155916042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).