2-[1-[(2-fluorophenyl)methyl]indazol-3-yl]-5-(methoxymethyl)-4-methyl-1,3-oxazole

C20H18FN3O2 — CID 18416654

IUPAC2-[1-[(2-fluorophenyl)methyl]indazol-3-yl]-5-(methoxymethyl)-4-methyl-1,3-oxazole
SMILESCOCc1oc(-c2nn(Cc3ccccc3F)c3ccccc23)nc1C
InChIInChI=1S/C20H18FN3O2/c1-13-18(12-25-2)26-20(22-13)19-15-8-4-6-10-17(15)24(23-19)11-14-7-3-5-9-16(14)21/h3-10H,11-12H2,1-2H3
InChIKeyJAJQXMIPTCKSAF-UHFFFAOYSA-N
MW351.38 g/mol
LogP4.33
Rot. Bonds5

About 2-[1-[(2-fluorophenyl)methyl]indazol-3-yl]-5-(methoxymethyl)-4-methyl-1,3-oxazole

2-[1-[(2-fluorophenyl)methyl]indazol-3-yl]-5-(methoxymethyl)-4-methyl-1,3-oxazole (PubChem CID 18416654) has the molecular formula C20H18FN3O2 and a molecular weight of 351.38 g/mol. Its IUPAC name is 2-[1-[(2-fluorophenyl)methyl]indazol-3-yl]-5-(methoxymethyl)-4-methyl-1,3-oxazole.

Molecular Properties

Compound Name2-[1-[(2-fluorophenyl)methyl]indazol-3-yl]-5-(methoxymethyl)-4-methyl-1,3-oxazole
PubChem CID18416654
Molecular FormulaC20H18FN3O2
Molecular Weight351.38 g/mol
Exact Mass351.14
IUPAC Name2-[1-[(2-fluorophenyl)methyl]indazol-3-yl]-5-(methoxymethyl)-4-methyl-1,3-oxazole
SMILESCOCc1oc(-c2nn(Cc3ccccc3F)c3ccccc23)nc1C
InChIInChI=1S/C20H18FN3O2/c1-13-18(12-25-2)26-20(22-13)19-15-8-4-6-10-17(15)24(23-19)11-14-7-3-5-9-16(14)21/h3-10H,11-12H2,1-2H3
InChIKeyJAJQXMIPTCKSAF-UHFFFAOYSA-N
XLogP4.33
TPSA53.08 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.38
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-[1-[(2-fluorophenyl)methyl]indazol-3-yl]-5-(methoxymethyl)-4-methyl-1,3-oxazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[1-[(2-fluorophenyl)methyl]indazol-3-yl]-5-(methoxymethyl)-4-methyl-1,3-oxazole?
The IUPAC name of 2-[1-[(2-fluorophenyl)methyl]indazol-3-yl]-5-(methoxymethyl)-4-methyl-1,3-oxazole (CID 18416654) is 2-[1-[(2-fluorophenyl)methyl]indazol-3-yl]-5-(methoxymethyl)-4-methyl-1,3-oxazole.
What is the SMILES notation for 2-[1-[(2-fluorophenyl)methyl]indazol-3-yl]-5-(methoxymethyl)-4-methyl-1,3-oxazole?
The canonical SMILES for 2-[1-[(2-fluorophenyl)methyl]indazol-3-yl]-5-(methoxymethyl)-4-methyl-1,3-oxazole is COCc1oc(-c2nn(Cc3ccccc3F)c3ccccc23)nc1C.
What is the InChIKey of 2-[1-[(2-fluorophenyl)methyl]indazol-3-yl]-5-(methoxymethyl)-4-methyl-1,3-oxazole?
The InChIKey is JAJQXMIPTCKSAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FN3O2/c1-13-18(12-25-2)26-20(22-13)19-15-8-4-6-10-17(15)24(23-19)11-14-7-3-5-9-16(14)21/h3-10H,11-12H2,1-2H3.
What are the key properties of 2-[1-[(2-fluorophenyl)methyl]indazol-3-yl]-5-(methoxymethyl)-4-methyl-1,3-oxazole?
2-[1-[(2-fluorophenyl)methyl]indazol-3-yl]-5-(methoxymethyl)-4-methyl-1,3-oxazole has a molecular weight of 351.38 g/mol, XLogP of 4.33, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(2-fluorophenyl)methyl]indazol-3-yl]-5-(methoxymethyl)-4-methyl-1,3-oxazole is sourced from PubChem (CID 18416654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).