[4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methylfuro[2,3-c]pyridin-7-yl]phenyl]methanol

C20H18N2O3 — CID 134807402

IUPAC[4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methylfuro[2,3-c]pyridin-7-yl]phenyl]methanol
SMILESCc1cc2cc(-c3c(C)noc3C)nc(-c3ccc(CO)cc3)c2o1
InChIInChI=1S/C20H18N2O3/c1-11-8-16-9-17(18-12(2)22-25-13(18)3)21-19(20(16)24-11)15-6-4-14(10-23)5-7-15/h4-9,23H,10H2,1-3H3
InChIKeyQEULTFZBUWOXNY-UHFFFAOYSA-N
MW334.38 g/mol
LogP4.57
Rot. Bonds3

About [4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methylfuro[2,3-c]pyridin-7-yl]phenyl]methanol

[4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methylfuro[2,3-c]pyridin-7-yl]phenyl]methanol (PubChem CID 134807402) has the molecular formula C20H18N2O3 and a molecular weight of 334.38 g/mol. Its IUPAC name is [4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methylfuro[2,3-c]pyridin-7-yl]phenyl]methanol.

Molecular Properties

Compound Name[4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methylfuro[2,3-c]pyridin-7-yl]phenyl]methanol
PubChem CID134807402
Molecular FormulaC20H18N2O3
Molecular Weight334.38 g/mol
Exact Mass334.13
IUPAC Name[4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methylfuro[2,3-c]pyridin-7-yl]phenyl]methanol
SMILESCc1cc2cc(-c3c(C)noc3C)nc(-c3ccc(CO)cc3)c2o1
InChIInChI=1S/C20H18N2O3/c1-11-8-16-9-17(18-12(2)22-25-13(18)3)21-19(20(16)24-11)15-6-4-14(10-23)5-7-15/h4-9,23H,10H2,1-3H3
InChIKeyQEULTFZBUWOXNY-UHFFFAOYSA-N
XLogP4.57
TPSA72.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methylfuro[2,3-c]pyridin-7-yl]phenyl]methanol?
The IUPAC name of [4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methylfuro[2,3-c]pyridin-7-yl]phenyl]methanol (CID 134807402) is [4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methylfuro[2,3-c]pyridin-7-yl]phenyl]methanol.
What is the SMILES notation for [4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methylfuro[2,3-c]pyridin-7-yl]phenyl]methanol?
The canonical SMILES for [4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methylfuro[2,3-c]pyridin-7-yl]phenyl]methanol is Cc1cc2cc(-c3c(C)noc3C)nc(-c3ccc(CO)cc3)c2o1.
What is the InChIKey of [4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methylfuro[2,3-c]pyridin-7-yl]phenyl]methanol?
The InChIKey is QEULTFZBUWOXNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O3/c1-11-8-16-9-17(18-12(2)22-25-13(18)3)21-19(20(16)24-11)15-6-4-14(10-23)5-7-15/h4-9,23H,10H2,1-3H3.
What are the key properties of [4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methylfuro[2,3-c]pyridin-7-yl]phenyl]methanol?
[4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methylfuro[2,3-c]pyridin-7-yl]phenyl]methanol has a molecular weight of 334.38 g/mol, XLogP of 4.57, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methylfuro[2,3-c]pyridin-7-yl]phenyl]methanol is sourced from PubChem (CID 134807402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).