4-methoxy-2-[5-(3-methyl-2-pyridinyl)-1,2-oxazol-3-yl]phenol

C16H14N2O3 — CID 135429336

IUPAC4-methoxy-2-[5-(3-methyl-2-pyridinyl)-1,2-oxazol-3-yl]phenol
SMILESCOc1ccc(O)c(-c2cc(-c3ncccc3C)on2)c1
InChIInChI=1S/C16H14N2O3/c1-10-4-3-7-17-16(10)15-9-13(18-21-15)12-8-11(20-2)5-6-14(12)19/h3-9,19H,1-2H3
InChIKeyFARVPNXFQWLJKS-UHFFFAOYSA-N
MW282.30 g/mol
LogP3.43
Rot. Bonds3

About 4-methoxy-2-[5-(3-methyl-2-pyridinyl)-1,2-oxazol-3-yl]phenol

4-methoxy-2-[5-(3-methyl-2-pyridinyl)-1,2-oxazol-3-yl]phenol (PubChem CID 135429336) has the molecular formula C16H14N2O3 and a molecular weight of 282.30 g/mol. Its IUPAC name is 4-methoxy-2-[5-(3-methyl-2-pyridinyl)-1,2-oxazol-3-yl]phenol.

Molecular Properties

Compound Name4-methoxy-2-[5-(3-methyl-2-pyridinyl)-1,2-oxazol-3-yl]phenol
PubChem CID135429336
Molecular FormulaC16H14N2O3
Molecular Weight282.30 g/mol
Exact Mass282.10
IUPAC Name4-methoxy-2-[5-(3-methyl-2-pyridinyl)-1,2-oxazol-3-yl]phenol
SMILESCOc1ccc(O)c(-c2cc(-c3ncccc3C)on2)c1
InChIInChI=1S/C16H14N2O3/c1-10-4-3-7-17-16(10)15-9-13(18-21-15)12-8-11(20-2)5-6-14(12)19/h3-9,19H,1-2H3
InChIKeyFARVPNXFQWLJKS-UHFFFAOYSA-N
XLogP3.43
TPSA68.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-[5-(3-methyl-2-pyridinyl)-1,2-oxazol-3-yl]phenol?
The IUPAC name of 4-methoxy-2-[5-(3-methyl-2-pyridinyl)-1,2-oxazol-3-yl]phenol (CID 135429336) is 4-methoxy-2-[5-(3-methyl-2-pyridinyl)-1,2-oxazol-3-yl]phenol.
What is the SMILES notation for 4-methoxy-2-[5-(3-methyl-2-pyridinyl)-1,2-oxazol-3-yl]phenol?
The canonical SMILES for 4-methoxy-2-[5-(3-methyl-2-pyridinyl)-1,2-oxazol-3-yl]phenol is COc1ccc(O)c(-c2cc(-c3ncccc3C)on2)c1.
What is the InChIKey of 4-methoxy-2-[5-(3-methyl-2-pyridinyl)-1,2-oxazol-3-yl]phenol?
The InChIKey is FARVPNXFQWLJKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O3/c1-10-4-3-7-17-16(10)15-9-13(18-21-15)12-8-11(20-2)5-6-14(12)19/h3-9,19H,1-2H3.
What are the key properties of 4-methoxy-2-[5-(3-methyl-2-pyridinyl)-1,2-oxazol-3-yl]phenol?
4-methoxy-2-[5-(3-methyl-2-pyridinyl)-1,2-oxazol-3-yl]phenol has a molecular weight of 282.30 g/mol, XLogP of 3.43, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-[5-(3-methyl-2-pyridinyl)-1,2-oxazol-3-yl]phenol is sourced from PubChem (CID 135429336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).