(7-methyl-[1,2]oxazolo[5,4-c]pyridin-4-yl)methanol

C8H8N2O2 — CID 101492948

IUPAC(7-methyl-[1,2]oxazolo[5,4-c]pyridin-4-yl)methanol
SMILESCc1ncc(CO)c2cnoc12
InChIInChI=1S/C8H8N2O2/c1-5-8-7(3-10-12-8)6(4-11)2-9-5/h2-3,11H,4H2,1H3
InChIKeyLPBLSTHZDHHAJN-UHFFFAOYSA-N
MW164.16 g/mol
LogP1.02
Rot. Bonds1

About (7-methyl-[1,2]oxazolo[5,4-c]pyridin-4-yl)methanol

(7-methyl-[1,2]oxazolo[5,4-c]pyridin-4-yl)methanol (PubChem CID 101492948) has the molecular formula C8H8N2O2 and a molecular weight of 164.16 g/mol. Its IUPAC name is (7-methyl-[1,2]oxazolo[5,4-c]pyridin-4-yl)methanol.

Molecular Properties

Compound Name(7-methyl-[1,2]oxazolo[5,4-c]pyridin-4-yl)methanol
PubChem CID101492948
Molecular FormulaC8H8N2O2
Molecular Weight164.16 g/mol
Exact Mass164.06
IUPAC Name(7-methyl-[1,2]oxazolo[5,4-c]pyridin-4-yl)methanol
SMILESCc1ncc(CO)c2cnoc12
InChIInChI=1S/C8H8N2O2/c1-5-8-7(3-10-12-8)6(4-11)2-9-5/h2-3,11H,4H2,1H3
InChIKeyLPBLSTHZDHHAJN-UHFFFAOYSA-N
XLogP1.02
TPSA59.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.16
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (7-methyl-[1,2]oxazolo[5,4-c]pyridin-4-yl)methanol?
The IUPAC name of (7-methyl-[1,2]oxazolo[5,4-c]pyridin-4-yl)methanol (CID 101492948) is (7-methyl-[1,2]oxazolo[5,4-c]pyridin-4-yl)methanol.
What is the SMILES notation for (7-methyl-[1,2]oxazolo[5,4-c]pyridin-4-yl)methanol?
The canonical SMILES for (7-methyl-[1,2]oxazolo[5,4-c]pyridin-4-yl)methanol is Cc1ncc(CO)c2cnoc12.
What is the InChIKey of (7-methyl-[1,2]oxazolo[5,4-c]pyridin-4-yl)methanol?
The InChIKey is LPBLSTHZDHHAJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O2/c1-5-8-7(3-10-12-8)6(4-11)2-9-5/h2-3,11H,4H2,1H3.
What are the key properties of (7-methyl-[1,2]oxazolo[5,4-c]pyridin-4-yl)methanol?
(7-methyl-[1,2]oxazolo[5,4-c]pyridin-4-yl)methanol has a molecular weight of 164.16 g/mol, XLogP of 1.02, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (7-methyl-[1,2]oxazolo[5,4-c]pyridin-4-yl)methanol is sourced from PubChem (CID 101492948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).