CID 58662919

C15H22NO2 — CID 58662919

IUPAC—
SMILESCC1(C)CC(Oc2ccccc2)CC(C)(C)N1[O]
InChIInChI=1S/C15H22NO2/c1-14(2)10-13(11-15(3,4)16(14)17)18-12-8-6-5-7-9-12/h5-9,13H,10-11H2,1-4H3
InChIKeyXNACDMPFQQJILJ-UHFFFAOYSA-N
MW248.35 g/mol
LogP3.43
Rot. Bonds2

About CID 58662919

CID 58662919 (PubChem CID 58662919) has the molecular formula C15H22NO2 and a molecular weight of 248.35 g/mol.

Molecular Properties

Compound NameCID 58662919
PubChem CID58662919
Molecular FormulaC15H22NO2
Molecular Weight248.35 g/mol
Exact Mass248.17
IUPAC Name—
SMILESCC1(C)CC(Oc2ccccc2)CC(C)(C)N1[O]
InChIInChI=1S/C15H22NO2/c1-14(2)10-13(11-15(3,4)16(14)17)18-12-8-6-5-7-9-12/h5-9,13H,10-11H2,1-4H3
InChIKeyXNACDMPFQQJILJ-UHFFFAOYSA-N
XLogP3.43
TPSA32.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.35
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 58662919?
The IUPAC name of CID 58662919 (CID 58662919) is not available.
What is the SMILES notation for CID 58662919?
The canonical SMILES for CID 58662919 is CC1(C)CC(Oc2ccccc2)CC(C)(C)N1[O].
What is the InChIKey of CID 58662919?
The InChIKey is XNACDMPFQQJILJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22NO2/c1-14(2)10-13(11-15(3,4)16(14)17)18-12-8-6-5-7-9-12/h5-9,13H,10-11H2,1-4H3.
What are the key properties of CID 58662919?
CID 58662919 has a molecular weight of 248.35 g/mol, XLogP of 3.43, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58662919 is sourced from PubChem (CID 58662919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).