CID 59497984

C4HF3N2O — CID 59497984

IUPAC—
SMILES[CH]c1nnc(C(F)(F)F)o1
InChIInChI=1S/C4HF3N2O/c1-2-8-9-3(10-2)4(5,6)7/h1H
InChIKeyFSGNAAAPPNLFJK-UHFFFAOYSA-N
MW150.06 g/mol
LogP1.15
Rot. Bonds

About CID 59497984

CID 59497984 (PubChem CID 59497984) has the molecular formula C4HF3N2O and a molecular weight of 150.06 g/mol.

Molecular Properties

Compound NameCID 59497984
PubChem CID59497984
Molecular FormulaC4HF3N2O
Molecular Weight150.06 g/mol
Exact Mass150.00
IUPAC Name—
SMILES[CH]c1nnc(C(F)(F)F)o1
InChIInChI=1S/C4HF3N2O/c1-2-8-9-3(10-2)4(5,6)7/h1H
InChIKeyFSGNAAAPPNLFJK-UHFFFAOYSA-N
XLogP1.15
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.06
LogP ≤ 51.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of CID 59497984?
The IUPAC name of CID 59497984 (CID 59497984) is not available.
What is the SMILES notation for CID 59497984?
The canonical SMILES for CID 59497984 is [CH]c1nnc(C(F)(F)F)o1.
What is the InChIKey of CID 59497984?
The InChIKey is FSGNAAAPPNLFJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C4HF3N2O/c1-2-8-9-3(10-2)4(5,6)7/h1H.
What are the key properties of CID 59497984?
CID 59497984 has a molecular weight of 150.06 g/mol, XLogP of 1.15, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59497984 is sourced from PubChem (CID 59497984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).