CID 134905673

C14H16O — CID 134905673

IUPAC—
SMILESCC1CC12c1ccccc1C1(CC1)[C@@H]2O
InChIInChI=1S/C14H16O/c1-9-8-14(9)11-5-3-2-4-10(11)13(6-7-13)12(14)15/h2-5,9,12,15H,6-8H2,1H3/t9?,12-,14?/m0/s1
InChIKeyQBPYALCESZYQPR-PEUVISTOSA-N
MW200.28 g/mol
LogP2.37
Rot. Bonds

About CID 134905673

CID 134905673 (PubChem CID 134905673) has the molecular formula C14H16O and a molecular weight of 200.28 g/mol.

Molecular Properties

Compound NameCID 134905673
PubChem CID134905673
Molecular FormulaC14H16O
Molecular Weight200.28 g/mol
Exact Mass200.12
IUPAC Name—
SMILESCC1CC12c1ccccc1C1(CC1)[C@@H]2O
InChIInChI=1S/C14H16O/c1-9-8-14(9)11-5-3-2-4-10(11)13(6-7-13)12(14)15/h2-5,9,12,15H,6-8H2,1H3/t9?,12-,14?/m0/s1
InChIKeyQBPYALCESZYQPR-PEUVISTOSA-N
XLogP2.37
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 134905673?
The IUPAC name of CID 134905673 (CID 134905673) is not available.
What is the SMILES notation for CID 134905673?
The canonical SMILES for CID 134905673 is CC1CC12c1ccccc1C1(CC1)[C@@H]2O.
What is the InChIKey of CID 134905673?
The InChIKey is QBPYALCESZYQPR-PEUVISTOSA-N. The full InChI is InChI=1S/C14H16O/c1-9-8-14(9)11-5-3-2-4-10(11)13(6-7-13)12(14)15/h2-5,9,12,15H,6-8H2,1H3/t9?,12-,14?/m0/s1.
What are the key properties of CID 134905673?
CID 134905673 has a molecular weight of 200.28 g/mol, XLogP of 2.37, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134905673 is sourced from PubChem (CID 134905673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).