CID 101355252

C14H20FO2 — CID 101355252

IUPAC—
SMILESCC(C)(C)c1cc(F)c(C(C)(C)C)c(O)c1[O]
InChIInChI=1S/C14H20FO2/c1-13(2,3)8-7-9(15)10(14(4,5)6)12(17)11(8)16/h7,17H,1-6H3
InChIKeyIZGFCPOVLNRPLS-UHFFFAOYSA-N
MW239.31 g/mol
LogP4.27
Rot. Bonds

About CID 101355252

CID 101355252 (PubChem CID 101355252) has the molecular formula C14H20FO2 and a molecular weight of 239.31 g/mol.

Molecular Properties

Compound NameCID 101355252
PubChem CID101355252
Molecular FormulaC14H20FO2
Molecular Weight239.31 g/mol
Exact Mass239.14
IUPAC Name—
SMILESCC(C)(C)c1cc(F)c(C(C)(C)C)c(O)c1[O]
InChIInChI=1S/C14H20FO2/c1-13(2,3)8-7-9(15)10(14(4,5)6)12(17)11(8)16/h7,17H,1-6H3
InChIKeyIZGFCPOVLNRPLS-UHFFFAOYSA-N
XLogP4.27
TPSA40.13 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.31
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 101355252?
The IUPAC name of CID 101355252 (CID 101355252) is not available.
What is the SMILES notation for CID 101355252?
The canonical SMILES for CID 101355252 is CC(C)(C)c1cc(F)c(C(C)(C)C)c(O)c1[O].
What is the InChIKey of CID 101355252?
The InChIKey is IZGFCPOVLNRPLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FO2/c1-13(2,3)8-7-9(15)10(14(4,5)6)12(17)11(8)16/h7,17H,1-6H3.
What are the key properties of CID 101355252?
CID 101355252 has a molecular weight of 239.31 g/mol, XLogP of 4.27, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 101355252 is sourced from PubChem (CID 101355252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).