1,6-bis(4-hydroxyphenyl)-1,6-diazaspiro[4.4]nonane-2,7-dione

C19H18N2O4 — CID 14512954

IUPAC1,6-bis(4-hydroxyphenyl)-1,6-diazaspiro[4.4]nonane-2,7-dione
SMILESO=C1CCC2(CCC(=O)N2c2ccc(O)cc2)N1c1ccc(O)cc1
InChIInChI=1S/C19H18N2O4/c22-15-5-1-13(2-6-15)20-17(24)9-11-19(20)12-10-18(25)21(19)14-3-7-16(23)8-4-14/h1-8,22-23H,9-12H2
InChIKeyQJBSWHJZBJOOPH-UHFFFAOYSA-N
MW338.36 g/mol
LogP2.75
Rot. Bonds2

About 1,6-bis(4-hydroxyphenyl)-1,6-diazaspiro[4.4]nonane-2,7-dione

1,6-bis(4-hydroxyphenyl)-1,6-diazaspiro[4.4]nonane-2,7-dione (PubChem CID 14512954) has the molecular formula C19H18N2O4 and a molecular weight of 338.36 g/mol. Its IUPAC name is 1,6-bis(4-hydroxyphenyl)-1,6-diazaspiro[4.4]nonane-2,7-dione.

Molecular Properties

Compound Name1,6-bis(4-hydroxyphenyl)-1,6-diazaspiro[4.4]nonane-2,7-dione
PubChem CID14512954
Molecular FormulaC19H18N2O4
Molecular Weight338.36 g/mol
Exact Mass338.13
IUPAC Name1,6-bis(4-hydroxyphenyl)-1,6-diazaspiro[4.4]nonane-2,7-dione
SMILESO=C1CCC2(CCC(=O)N2c2ccc(O)cc2)N1c1ccc(O)cc1
InChIInChI=1S/C19H18N2O4/c22-15-5-1-13(2-6-15)20-17(24)9-11-19(20)12-10-18(25)21(19)14-3-7-16(23)8-4-14/h1-8,22-23H,9-12H2
InChIKeyQJBSWHJZBJOOPH-UHFFFAOYSA-N
XLogP2.75
TPSA81.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.36
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1,6-bis(4-hydroxyphenyl)-1,6-diazaspiro[4.4]nonane-2,7-dione?
The IUPAC name of 1,6-bis(4-hydroxyphenyl)-1,6-diazaspiro[4.4]nonane-2,7-dione (CID 14512954) is 1,6-bis(4-hydroxyphenyl)-1,6-diazaspiro[4.4]nonane-2,7-dione.
What is the SMILES notation for 1,6-bis(4-hydroxyphenyl)-1,6-diazaspiro[4.4]nonane-2,7-dione?
The canonical SMILES for 1,6-bis(4-hydroxyphenyl)-1,6-diazaspiro[4.4]nonane-2,7-dione is O=C1CCC2(CCC(=O)N2c2ccc(O)cc2)N1c1ccc(O)cc1.
What is the InChIKey of 1,6-bis(4-hydroxyphenyl)-1,6-diazaspiro[4.4]nonane-2,7-dione?
The InChIKey is QJBSWHJZBJOOPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O4/c22-15-5-1-13(2-6-15)20-17(24)9-11-19(20)12-10-18(25)21(19)14-3-7-16(23)8-4-14/h1-8,22-23H,9-12H2.
What are the key properties of 1,6-bis(4-hydroxyphenyl)-1,6-diazaspiro[4.4]nonane-2,7-dione?
1,6-bis(4-hydroxyphenyl)-1,6-diazaspiro[4.4]nonane-2,7-dione has a molecular weight of 338.36 g/mol, XLogP of 2.75, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,6-bis(4-hydroxyphenyl)-1,6-diazaspiro[4.4]nonane-2,7-dione is sourced from PubChem (CID 14512954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).