CID 140721060

C10H5F5NO2 — CID 140721060

IUPAC—
SMILESO=C1[N]c2cccc([C@@H](O)C(F)(F)F)c2C1(F)F
InChIInChI=1S/C10H5F5NO2/c11-9(12)6-4(7(17)10(13,14)15)2-1-3-5(6)16-8(9)18/h1-3,7,17H/t7-/m1/s1
InChIKeyHYXBPKVSNWYNRQ-SSDOTTSWSA-N
MW266.14 g/mol
LogP2.15
Rot. Bonds1

About CID 140721060

CID 140721060 (PubChem CID 140721060) has the molecular formula C10H5F5NO2 and a molecular weight of 266.14 g/mol.

Molecular Properties

Compound NameCID 140721060
PubChem CID140721060
Molecular FormulaC10H5F5NO2
Molecular Weight266.14 g/mol
Exact Mass266.02
IUPAC Name—
SMILESO=C1[N]c2cccc([C@@H](O)C(F)(F)F)c2C1(F)F
InChIInChI=1S/C10H5F5NO2/c11-9(12)6-4(7(17)10(13,14)15)2-1-3-5(6)16-8(9)18/h1-3,7,17H/t7-/m1/s1
InChIKeyHYXBPKVSNWYNRQ-SSDOTTSWSA-N
XLogP2.15
TPSA51.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.14
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 140721060?
The IUPAC name of CID 140721060 (CID 140721060) is not available.
What is the SMILES notation for CID 140721060?
The canonical SMILES for CID 140721060 is O=C1[N]c2cccc([C@@H](O)C(F)(F)F)c2C1(F)F.
What is the InChIKey of CID 140721060?
The InChIKey is HYXBPKVSNWYNRQ-SSDOTTSWSA-N. The full InChI is InChI=1S/C10H5F5NO2/c11-9(12)6-4(7(17)10(13,14)15)2-1-3-5(6)16-8(9)18/h1-3,7,17H/t7-/m1/s1.
What are the key properties of CID 140721060?
CID 140721060 has a molecular weight of 266.14 g/mol, XLogP of 2.15, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 140721060 is sourced from PubChem (CID 140721060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).