CID 102134407

C11H18F3N2O2 — CID 102134407

IUPAC—
SMILESCC1(C)CC(NC(=O)C(F)(F)F)CC(C)(C)N1[O]
InChIInChI=1S/C11H18F3N2O2/c1-9(2)5-7(6-10(3,4)16(9)18)15-8(17)11(12,13)14/h7H,5-6H2,1-4H3,(H,15,17)
InChIKeyPBVMYHARINNOMP-UHFFFAOYSA-N
MW267.27 g/mol
LogP2.03
Rot. Bonds1

About CID 102134407

CID 102134407 (PubChem CID 102134407) has the molecular formula C11H18F3N2O2 and a molecular weight of 267.27 g/mol.

Molecular Properties

Compound NameCID 102134407
PubChem CID102134407
Molecular FormulaC11H18F3N2O2
Molecular Weight267.27 g/mol
Exact Mass267.13
IUPAC Name—
SMILESCC1(C)CC(NC(=O)C(F)(F)F)CC(C)(C)N1[O]
InChIInChI=1S/C11H18F3N2O2/c1-9(2)5-7(6-10(3,4)16(9)18)15-8(17)11(12,13)14/h7H,5-6H2,1-4H3,(H,15,17)
InChIKeyPBVMYHARINNOMP-UHFFFAOYSA-N
XLogP2.03
TPSA52.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.27
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 102134407?
The IUPAC name of CID 102134407 (CID 102134407) is not available.
What is the SMILES notation for CID 102134407?
The canonical SMILES for CID 102134407 is CC1(C)CC(NC(=O)C(F)(F)F)CC(C)(C)N1[O].
What is the InChIKey of CID 102134407?
The InChIKey is PBVMYHARINNOMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18F3N2O2/c1-9(2)5-7(6-10(3,4)16(9)18)15-8(17)11(12,13)14/h7H,5-6H2,1-4H3,(H,15,17).
What are the key properties of CID 102134407?
CID 102134407 has a molecular weight of 267.27 g/mol, XLogP of 2.03, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 102134407 is sourced from PubChem (CID 102134407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).