2-anilino-2-azaspiro[4.4]nonane-1,3-dione

C14H16N2O2 — CID 11368541

IUPAC2-anilino-2-azaspiro[4.4]nonane-1,3-dione
SMILESO=C1CC2(CCCC2)C(=O)N1Nc1ccccc1
InChIInChI=1S/C14H16N2O2/c17-12-10-14(8-4-5-9-14)13(18)16(12)15-11-6-2-1-3-7-11/h1-3,6-7,15H,4-5,8-10H2
InChIKeyCYXJMPWLWMBXHO-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.33
Rot. Bonds2

About 2-anilino-2-azaspiro[4.4]nonane-1,3-dione

2-anilino-2-azaspiro[4.4]nonane-1,3-dione (PubChem CID 11368541) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 2-anilino-2-azaspiro[4.4]nonane-1,3-dione.

Molecular Properties

Compound Name2-anilino-2-azaspiro[4.4]nonane-1,3-dione
PubChem CID11368541
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name2-anilino-2-azaspiro[4.4]nonane-1,3-dione
SMILESO=C1CC2(CCCC2)C(=O)N1Nc1ccccc1
InChIInChI=1S/C14H16N2O2/c17-12-10-14(8-4-5-9-14)13(18)16(12)15-11-6-2-1-3-7-11/h1-3,6-7,15H,4-5,8-10H2
InChIKeyCYXJMPWLWMBXHO-UHFFFAOYSA-N
XLogP2.33
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

2-(phenylamino)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
CID 2831237
3a,4,7,7a-Tetrahydro-2-(phenylamino)-1H-isoindole-1,3(2H)-dione
CID 43555
2,5-Pyrrolidinedione, 1-(phenylamino)-
CID 97064
2-(2,4-Dichloroanilino)-2-azaspiro[4.4]nonane-1,3-dione
CID 24795310
2-(4-Bromoanilino)-2-azaspiro[4.5]decane-1,3-dione
CID 24795431
2-(2-Chloroanilino)-2-azaspiro[4.4]nonane-1,3-dione
CID 24795435
2-(4-Bromoanilino)-2-azaspiro[4.4]nonane-1,3-dione
CID 24795436
1-Anilino-3,3-dimethylpyrrolidine-2,5-dione
CID 264240
3-Phenyl-1-(4-propan-2-ylanilino)pyrrolidine-2,5-dione
CID 2826181
2-(2-Chloroanilino)-2-azaspiro[4.5]decane-1,3-dione
CID 24795430
2-Anilino-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
CID 25014798
3,3-Dimethyl-1-(4-methylanilino)pyrrolidine-2,5-dione
CID 44576473

Frequently Asked Questions

What is the IUPAC name of 2-anilino-2-azaspiro[4.4]nonane-1,3-dione?
The IUPAC name of 2-anilino-2-azaspiro[4.4]nonane-1,3-dione (CID 11368541) is 2-anilino-2-azaspiro[4.4]nonane-1,3-dione.
What is the SMILES notation for 2-anilino-2-azaspiro[4.4]nonane-1,3-dione?
The canonical SMILES for 2-anilino-2-azaspiro[4.4]nonane-1,3-dione is O=C1CC2(CCCC2)C(=O)N1Nc1ccccc1.
What is the InChIKey of 2-anilino-2-azaspiro[4.4]nonane-1,3-dione?
The InChIKey is CYXJMPWLWMBXHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c17-12-10-14(8-4-5-9-14)13(18)16(12)15-11-6-2-1-3-7-11/h1-3,6-7,15H,4-5,8-10H2.
What are the key properties of 2-anilino-2-azaspiro[4.4]nonane-1,3-dione?
2-anilino-2-azaspiro[4.4]nonane-1,3-dione has a molecular weight of 244.29 g/mol, XLogP of 2.33, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-2-azaspiro[4.4]nonane-1,3-dione is sourced from PubChem (CID 11368541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).