7-cyclohexyl-N-(2-fluorophenyl)-6-oxo-2,7-diazaspiro[4.5]decane-2-carboxamide

C21H28FN3O2 — CID 72866796

IUPAC7-cyclohexyl-N-(2-fluorophenyl)-6-oxo-2,7-diazaspiro[4.5]decane-2-carboxamide
SMILESO=C(Nc1ccccc1F)N1CCC2(CCCN(C3CCCCC3)C2=O)C1
InChIInChI=1S/C21H28FN3O2/c22-17-9-4-5-10-18(17)23-20(27)24-14-12-21(15-24)11-6-13-25(19(21)26)16-7-2-1-3-8-16/h4-5,9-10,16H,1-3,6-8,11-15H2,(H,23,27)
InChIKeyYNOQYBDVXYOCPM-UHFFFAOYSA-N
MW373.47 g/mol
LogP4.00
Rot. Bonds2

About 7-cyclohexyl-N-(2-fluorophenyl)-6-oxo-2,7-diazaspiro[4.5]decane-2-carboxamide

7-cyclohexyl-N-(2-fluorophenyl)-6-oxo-2,7-diazaspiro[4.5]decane-2-carboxamide (PubChem CID 72866796) has the molecular formula C21H28FN3O2 and a molecular weight of 373.47 g/mol. Its IUPAC name is 7-cyclohexyl-N-(2-fluorophenyl)-6-oxo-2,7-diazaspiro[4.5]decane-2-carboxamide.

Molecular Properties

Compound Name7-cyclohexyl-N-(2-fluorophenyl)-6-oxo-2,7-diazaspiro[4.5]decane-2-carboxamide
PubChem CID72866796
Molecular FormulaC21H28FN3O2
Molecular Weight373.47 g/mol
Exact Mass373.22
IUPAC Name7-cyclohexyl-N-(2-fluorophenyl)-6-oxo-2,7-diazaspiro[4.5]decane-2-carboxamide
SMILESO=C(Nc1ccccc1F)N1CCC2(CCCN(C3CCCCC3)C2=O)C1
InChIInChI=1S/C21H28FN3O2/c22-17-9-4-5-10-18(17)23-20(27)24-14-12-21(15-24)11-6-13-25(19(21)26)16-7-2-1-3-8-16/h4-5,9-10,16H,1-3,6-8,11-15H2,(H,23,27)
InChIKeyYNOQYBDVXYOCPM-UHFFFAOYSA-N
XLogP4.00
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.47
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-cyclohexyl-N-(2-fluorophenyl)-6-oxo-2,7-diazaspiro[4.5]decane-2-carboxamide?
The IUPAC name of 7-cyclohexyl-N-(2-fluorophenyl)-6-oxo-2,7-diazaspiro[4.5]decane-2-carboxamide (CID 72866796) is 7-cyclohexyl-N-(2-fluorophenyl)-6-oxo-2,7-diazaspiro[4.5]decane-2-carboxamide.
What is the SMILES notation for 7-cyclohexyl-N-(2-fluorophenyl)-6-oxo-2,7-diazaspiro[4.5]decane-2-carboxamide?
The canonical SMILES for 7-cyclohexyl-N-(2-fluorophenyl)-6-oxo-2,7-diazaspiro[4.5]decane-2-carboxamide is O=C(Nc1ccccc1F)N1CCC2(CCCN(C3CCCCC3)C2=O)C1.
What is the InChIKey of 7-cyclohexyl-N-(2-fluorophenyl)-6-oxo-2,7-diazaspiro[4.5]decane-2-carboxamide?
The InChIKey is YNOQYBDVXYOCPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28FN3O2/c22-17-9-4-5-10-18(17)23-20(27)24-14-12-21(15-24)11-6-13-25(19(21)26)16-7-2-1-3-8-16/h4-5,9-10,16H,1-3,6-8,11-15H2,(H,23,27).
What are the key properties of 7-cyclohexyl-N-(2-fluorophenyl)-6-oxo-2,7-diazaspiro[4.5]decane-2-carboxamide?
7-cyclohexyl-N-(2-fluorophenyl)-6-oxo-2,7-diazaspiro[4.5]decane-2-carboxamide has a molecular weight of 373.47 g/mol, XLogP of 4.00, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-cyclohexyl-N-(2-fluorophenyl)-6-oxo-2,7-diazaspiro[4.5]decane-2-carboxamide is sourced from PubChem (CID 72866796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).