1,2-bis(4-fluorophenyl)-3-oxo-2,7-diazaspiro[3.5]nonane-7-carboxamide

C20H19F2N3O2 — CID 70304123

IUPAC1,2-bis(4-fluorophenyl)-3-oxo-2,7-diazaspiro[3.5]nonane-7-carboxamide
SMILESNC(=O)N1CCC2(CC1)C(=O)N(c1ccc(F)cc1)C2c1ccc(F)cc1
InChIInChI=1S/C20H19F2N3O2/c21-14-3-1-13(2-4-14)17-20(9-11-24(12-10-20)19(23)27)18(26)25(17)16-7-5-15(22)6-8-16/h1-8,17H,9-12H2,(H2,23,27)
InChIKeyYIKWJOQGDGTZSN-UHFFFAOYSA-N
MW371.39 g/mol
LogP3.21
Rot. Bonds2

About 1,2-bis(4-fluorophenyl)-3-oxo-2,7-diazaspiro[3.5]nonane-7-carboxamide

1,2-bis(4-fluorophenyl)-3-oxo-2,7-diazaspiro[3.5]nonane-7-carboxamide (PubChem CID 70304123) has the molecular formula C20H19F2N3O2 and a molecular weight of 371.39 g/mol. Its IUPAC name is 1,2-bis(4-fluorophenyl)-3-oxo-2,7-diazaspiro[3.5]nonane-7-carboxamide.

Molecular Properties

Compound Name1,2-bis(4-fluorophenyl)-3-oxo-2,7-diazaspiro[3.5]nonane-7-carboxamide
PubChem CID70304123
Molecular FormulaC20H19F2N3O2
Molecular Weight371.39 g/mol
Exact Mass371.14
IUPAC Name1,2-bis(4-fluorophenyl)-3-oxo-2,7-diazaspiro[3.5]nonane-7-carboxamide
SMILESNC(=O)N1CCC2(CC1)C(=O)N(c1ccc(F)cc1)C2c1ccc(F)cc1
InChIInChI=1S/C20H19F2N3O2/c21-14-3-1-13(2-4-14)17-20(9-11-24(12-10-20)19(23)27)18(26)25(17)16-7-5-15(22)6-8-16/h1-8,17H,9-12H2,(H2,23,27)
InChIKeyYIKWJOQGDGTZSN-UHFFFAOYSA-N
XLogP3.21
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.39
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,2-bis(4-fluorophenyl)-3-oxo-2,7-diazaspiro[3.5]nonane-7-carboxamide?
The IUPAC name of 1,2-bis(4-fluorophenyl)-3-oxo-2,7-diazaspiro[3.5]nonane-7-carboxamide (CID 70304123) is 1,2-bis(4-fluorophenyl)-3-oxo-2,7-diazaspiro[3.5]nonane-7-carboxamide.
What is the SMILES notation for 1,2-bis(4-fluorophenyl)-3-oxo-2,7-diazaspiro[3.5]nonane-7-carboxamide?
The canonical SMILES for 1,2-bis(4-fluorophenyl)-3-oxo-2,7-diazaspiro[3.5]nonane-7-carboxamide is NC(=O)N1CCC2(CC1)C(=O)N(c1ccc(F)cc1)C2c1ccc(F)cc1.
What is the InChIKey of 1,2-bis(4-fluorophenyl)-3-oxo-2,7-diazaspiro[3.5]nonane-7-carboxamide?
The InChIKey is YIKWJOQGDGTZSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19F2N3O2/c21-14-3-1-13(2-4-14)17-20(9-11-24(12-10-20)19(23)27)18(26)25(17)16-7-5-15(22)6-8-16/h1-8,17H,9-12H2,(H2,23,27).
What are the key properties of 1,2-bis(4-fluorophenyl)-3-oxo-2,7-diazaspiro[3.5]nonane-7-carboxamide?
1,2-bis(4-fluorophenyl)-3-oxo-2,7-diazaspiro[3.5]nonane-7-carboxamide has a molecular weight of 371.39 g/mol, XLogP of 3.21, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-bis(4-fluorophenyl)-3-oxo-2,7-diazaspiro[3.5]nonane-7-carboxamide is sourced from PubChem (CID 70304123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).