CID 20593720

C16H24O2 — CID 20593720

IUPAC—
SMILESCC1C2CC(C1C)C1(C2)CC2(CCCC2)OC1=O
InChIInChI=1S/C16H24O2/c1-10-11(2)13-7-12(10)8-16(13)9-15(18-14(16)17)5-3-4-6-15/h10-13H,3-9H2,1-2H3
InChIKeyGLHNLNBBDYSFMK-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.54
Rot. Bonds

About CID 20593720

CID 20593720 (PubChem CID 20593720) has the molecular formula C16H24O2 and a molecular weight of 248.37 g/mol.

Molecular Properties

Compound NameCID 20593720
PubChem CID20593720
Molecular FormulaC16H24O2
Molecular Weight248.37 g/mol
Exact Mass248.18
IUPAC Name—
SMILESCC1C2CC(C1C)C1(C2)CC2(CCCC2)OC1=O
InChIInChI=1S/C16H24O2/c1-10-11(2)13-7-12(10)8-16(13)9-15(18-14(16)17)5-3-4-6-15/h10-13H,3-9H2,1-2H3
InChIKeyGLHNLNBBDYSFMK-UHFFFAOYSA-N
XLogP3.54
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 20593720?
The IUPAC name of CID 20593720 (CID 20593720) is not available.
What is the SMILES notation for CID 20593720?
The canonical SMILES for CID 20593720 is CC1C2CC(C1C)C1(C2)CC2(CCCC2)OC1=O.
What is the InChIKey of CID 20593720?
The InChIKey is GLHNLNBBDYSFMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24O2/c1-10-11(2)13-7-12(10)8-16(13)9-15(18-14(16)17)5-3-4-6-15/h10-13H,3-9H2,1-2H3.
What are the key properties of CID 20593720?
CID 20593720 has a molecular weight of 248.37 g/mol, XLogP of 3.54, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 20593720 is sourced from PubChem (CID 20593720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).