CID 59418449

C10H7FN2O2 — CID 59418449

IUPAC—
SMILES[CH]c1ccc(F)c(-c2nn(C)c(=O)o2)c1
InChIInChI=1S/C10H7FN2O2/c1-6-3-4-8(11)7(5-6)9-12-13(2)10(14)15-9/h1,3-5H,2H3
InChIKeyGILCAJOMIPVTDU-UHFFFAOYSA-N
MW206.18 g/mol
LogP1.24
Rot. Bonds1

About CID 59418449

CID 59418449 (PubChem CID 59418449) has the molecular formula C10H7FN2O2 and a molecular weight of 206.18 g/mol.

Molecular Properties

Compound NameCID 59418449
PubChem CID59418449
Molecular FormulaC10H7FN2O2
Molecular Weight206.18 g/mol
Exact Mass206.05
IUPAC Name—
SMILES[CH]c1ccc(F)c(-c2nn(C)c(=O)o2)c1
InChIInChI=1S/C10H7FN2O2/c1-6-3-4-8(11)7(5-6)9-12-13(2)10(14)15-9/h1,3-5H,2H3
InChIKeyGILCAJOMIPVTDU-UHFFFAOYSA-N
XLogP1.24
TPSA48.03 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.18
LogP ≤ 51.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-(4-Fluorophenyl)-1,3,4-oxadiazol-2(3H)-one
CID 2535079
5-[3-(trifluoromethyl)phenyl]-3H-1,3,4-oxadiazol-2-one
CID 64194180
5-(3-Ethylphenyl)-1,3,4-oxadiazol-2-ol
CID 146425078
5-(3-Methylphenyl)-1,3,4-oxadiazol-2(3H)-one
CID 14173559
5-(2-Fluorophenyl)-1,3,4-oxadiazol-2(3H)-one
CID 24902248
5-(3-Fluorophenyl)-1,3,4-oxadiazol-2(3H)-one
CID 24902250
5-(3-(Difluoromethyl)phenyl)-1,3,4-oxadiazol-2-ol
CID 151690443
2-[5-(4-Fluorophenyl)-2-oxo-2,3-dihydro-1,3,4-oxadiazol-3-yl]acetic acid
CID 2560682
5-(3-Methyl-5-(trifluoromethyl)phenyl)-1,3,4-oxadiazol-2-ol
CID 151625432
5-[2-Methyl-3-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-ol
CID 152726298
5-(3,5-Dimethylphenyl)-1,3,4-oxadiazol-2-ol
CID 64193809
3-But-3-enyl-5-phenyl-1,3,4-oxadiazol-2-one
CID 359328

Frequently Asked Questions

What is the IUPAC name of CID 59418449?
The IUPAC name of CID 59418449 (CID 59418449) is not available.
What is the SMILES notation for CID 59418449?
The canonical SMILES for CID 59418449 is [CH]c1ccc(F)c(-c2nn(C)c(=O)o2)c1.
What is the InChIKey of CID 59418449?
The InChIKey is GILCAJOMIPVTDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7FN2O2/c1-6-3-4-8(11)7(5-6)9-12-13(2)10(14)15-9/h1,3-5H,2H3.
What are the key properties of CID 59418449?
CID 59418449 has a molecular weight of 206.18 g/mol, XLogP of 1.24, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59418449 is sourced from PubChem (CID 59418449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).