2-[4-(2,4-dihydroxyphenyl)cyclohexyl]ethylazanide;bis(yttrium)

C14H20NO2Y2- — CID 59918616

IUPAC2-[4-(2,4-dihydroxyphenyl)cyclohexyl]ethylazanide;bis(yttrium)
SMILES[NH-]CCC1CCC(c2ccc(O)cc2O)CC1.[Y].[Y]
InChIInChI=1S/C14H20NO2.2Y/c15-8-7-10-1-3-11(4-2-10)13-6-5-12(16)9-14(13)17;;/h5-6,9-11,15-17H,1-4,7-8H2;;/q-1;;
InChIKeyRWGWXOBELFFNNJ-UHFFFAOYSA-N
MW412.13 g/mol
LogP3.81
Rot. Bonds3

About 2-[4-(2,4-dihydroxyphenyl)cyclohexyl]ethylazanide;bis(yttrium)

2-[4-(2,4-dihydroxyphenyl)cyclohexyl]ethylazanide;bis(yttrium) (PubChem CID 59918616) has the molecular formula C14H20NO2Y2- and a molecular weight of 412.13 g/mol. Its IUPAC name is 2-[4-(2,4-dihydroxyphenyl)cyclohexyl]ethylazanide;bis(yttrium).

Molecular Properties

Compound Name2-[4-(2,4-dihydroxyphenyl)cyclohexyl]ethylazanide;bis(yttrium)
PubChem CID59918616
Molecular FormulaC14H20NO2Y2-
Molecular Weight412.13 g/mol
Exact Mass411.96
IUPAC Name2-[4-(2,4-dihydroxyphenyl)cyclohexyl]ethylazanide;bis(yttrium)
SMILES[NH-]CCC1CCC(c2ccc(O)cc2O)CC1.[Y].[Y]
InChIInChI=1S/C14H20NO2.2Y/c15-8-7-10-1-3-11(4-2-10)13-6-5-12(16)9-14(13)17;;/h5-6,9-11,15-17H,1-4,7-8H2;;/q-1;;
InChIKeyRWGWXOBELFFNNJ-UHFFFAOYSA-N
XLogP3.81
TPSA64.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.13
LogP ≤ 53.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(2,4-dihydroxyphenyl)cyclohexyl]ethylazanide;bis(yttrium)?
The IUPAC name of 2-[4-(2,4-dihydroxyphenyl)cyclohexyl]ethylazanide;bis(yttrium) (CID 59918616) is 2-[4-(2,4-dihydroxyphenyl)cyclohexyl]ethylazanide;bis(yttrium).
What is the SMILES notation for 2-[4-(2,4-dihydroxyphenyl)cyclohexyl]ethylazanide;bis(yttrium)?
The canonical SMILES for 2-[4-(2,4-dihydroxyphenyl)cyclohexyl]ethylazanide;bis(yttrium) is [NH-]CCC1CCC(c2ccc(O)cc2O)CC1.[Y].[Y].
What is the InChIKey of 2-[4-(2,4-dihydroxyphenyl)cyclohexyl]ethylazanide;bis(yttrium)?
The InChIKey is RWGWXOBELFFNNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20NO2.2Y/c15-8-7-10-1-3-11(4-2-10)13-6-5-12(16)9-14(13)17;;/h5-6,9-11,15-17H,1-4,7-8H2;;/q-1;;.
What are the key properties of 2-[4-(2,4-dihydroxyphenyl)cyclohexyl]ethylazanide;bis(yttrium)?
2-[4-(2,4-dihydroxyphenyl)cyclohexyl]ethylazanide;bis(yttrium) has a molecular weight of 412.13 g/mol, XLogP of 3.81, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2,4-dihydroxyphenyl)cyclohexyl]ethylazanide;bis(yttrium) is sourced from PubChem (CID 59918616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).