Tempone

C9H16NO2 — CID 520789

IUPAC—
SMILESCC1(C)CC(=O)CC(C)(C)N1[O]
InChIInChI=1S/C9H16NO2/c1-8(2)5-7(11)6-9(3,4)10(8)12/h5-6H2,1-4H3
InChIKeyWSGDRFHJFJRSFY-UHFFFAOYSA-N
MW170.23 g/mol
LogP1.55
Rot. Bonds

About Tempone

Tempone (PubChem CID 520789) has the molecular formula C9H16NO2 and a molecular weight of 170.23 g/mol.

Molecular Properties

Compound NameTempone
PubChem CID520789
Molecular FormulaC9H16NO2
Molecular Weight170.23 g/mol
Exact Mass170.12
IUPAC Name—
SMILESCC1(C)CC(=O)CC(C)(C)N1[O]
InChIInChI=1S/C9H16NO2/c1-8(2)5-7(11)6-9(3,4)10(8)12/h5-6H2,1-4H3
InChIKeyWSGDRFHJFJRSFY-UHFFFAOYSA-N
XLogP1.55
TPSA40.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.23
LogP ≤ 51.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of Tempone?
The IUPAC name of Tempone (CID 520789) is not available.
What is the SMILES notation for Tempone?
The canonical SMILES for Tempone is CC1(C)CC(=O)CC(C)(C)N1[O].
What is the InChIKey of Tempone?
The InChIKey is WSGDRFHJFJRSFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16NO2/c1-8(2)5-7(11)6-9(3,4)10(8)12/h5-6H2,1-4H3.
What are the key properties of Tempone?
Tempone has a molecular weight of 170.23 g/mol, XLogP of 1.55, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for Tempone is sourced from PubChem (CID 520789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).