9-(4-chlorophenyl)-6,9-diazaspiro[4.5]decane-7,10-dione

C14H15ClN2O2 — CID 64961297

IUPAC9-(4-chlorophenyl)-6,9-diazaspiro[4.5]decane-7,10-dione
SMILESO=C1CN(c2ccc(Cl)cc2)C(=O)C2(CCCC2)N1
InChIInChI=1S/C14H15ClN2O2/c15-10-3-5-11(6-4-10)17-9-12(18)16-14(13(17)19)7-1-2-8-14/h3-6H,1-2,7-9H2,(H,16,18)
InChIKeyDVYMCYJXIWVQFS-UHFFFAOYSA-N
MW278.74 g/mol
LogP2.12
Rot. Bonds1

About 9-(4-chlorophenyl)-6,9-diazaspiro[4.5]decane-7,10-dione

9-(4-chlorophenyl)-6,9-diazaspiro[4.5]decane-7,10-dione (PubChem CID 64961297) has the molecular formula C14H15ClN2O2 and a molecular weight of 278.74 g/mol. Its IUPAC name is 9-(4-chlorophenyl)-6,9-diazaspiro[4.5]decane-7,10-dione.

Molecular Properties

Compound Name9-(4-chlorophenyl)-6,9-diazaspiro[4.5]decane-7,10-dione
PubChem CID64961297
Molecular FormulaC14H15ClN2O2
Molecular Weight278.74 g/mol
Exact Mass278.08
IUPAC Name9-(4-chlorophenyl)-6,9-diazaspiro[4.5]decane-7,10-dione
SMILESO=C1CN(c2ccc(Cl)cc2)C(=O)C2(CCCC2)N1
InChIInChI=1S/C14H15ClN2O2/c15-10-3-5-11(6-4-10)17-9-12(18)16-14(13(17)19)7-1-2-8-14/h3-6H,1-2,7-9H2,(H,16,18)
InChIKeyDVYMCYJXIWVQFS-UHFFFAOYSA-N
XLogP2.12
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.74
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-(4-chlorophenyl)-6,9-diazaspiro[4.5]decane-7,10-dione?
The IUPAC name of 9-(4-chlorophenyl)-6,9-diazaspiro[4.5]decane-7,10-dione (CID 64961297) is 9-(4-chlorophenyl)-6,9-diazaspiro[4.5]decane-7,10-dione.
What is the SMILES notation for 9-(4-chlorophenyl)-6,9-diazaspiro[4.5]decane-7,10-dione?
The canonical SMILES for 9-(4-chlorophenyl)-6,9-diazaspiro[4.5]decane-7,10-dione is O=C1CN(c2ccc(Cl)cc2)C(=O)C2(CCCC2)N1.
What is the InChIKey of 9-(4-chlorophenyl)-6,9-diazaspiro[4.5]decane-7,10-dione?
The InChIKey is DVYMCYJXIWVQFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O2/c15-10-3-5-11(6-4-10)17-9-12(18)16-14(13(17)19)7-1-2-8-14/h3-6H,1-2,7-9H2,(H,16,18).
What are the key properties of 9-(4-chlorophenyl)-6,9-diazaspiro[4.5]decane-7,10-dione?
9-(4-chlorophenyl)-6,9-diazaspiro[4.5]decane-7,10-dione has a molecular weight of 278.74 g/mol, XLogP of 2.12, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-chlorophenyl)-6,9-diazaspiro[4.5]decane-7,10-dione is sourced from PubChem (CID 64961297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).