3-oxo-2-phenyl-N-propan-2-yl-2,7-diazaspiro[4.4]nonane-7-carboxamide

C17H23N3O2 — CID 118741086

IUPAC3-oxo-2-phenyl-N-propan-2-yl-2,7-diazaspiro[4.4]nonane-7-carboxamide
SMILESCC(C)NC(=O)N1CCC2(CC(=O)N(c3ccccc3)C2)C1
InChIInChI=1S/C17H23N3O2/c1-13(2)18-16(22)19-9-8-17(11-19)10-15(21)20(12-17)14-6-4-3-5-7-14/h3-7,13H,8-12H2,1-2H3,(H,18,22)
InChIKeyUGPIZVYJCXCQHL-UHFFFAOYSA-N
MW301.39 g/mol
LogP2.23
Rot. Bonds2

About 3-oxo-2-phenyl-N-propan-2-yl-2,7-diazaspiro[4.4]nonane-7-carboxamide

3-oxo-2-phenyl-N-propan-2-yl-2,7-diazaspiro[4.4]nonane-7-carboxamide (PubChem CID 118741086) has the molecular formula C17H23N3O2 and a molecular weight of 301.39 g/mol. Its IUPAC name is 3-oxo-2-phenyl-N-propan-2-yl-2,7-diazaspiro[4.4]nonane-7-carboxamide.

Molecular Properties

Compound Name3-oxo-2-phenyl-N-propan-2-yl-2,7-diazaspiro[4.4]nonane-7-carboxamide
PubChem CID118741086
Molecular FormulaC17H23N3O2
Molecular Weight301.39 g/mol
Exact Mass301.18
IUPAC Name3-oxo-2-phenyl-N-propan-2-yl-2,7-diazaspiro[4.4]nonane-7-carboxamide
SMILESCC(C)NC(=O)N1CCC2(CC(=O)N(c3ccccc3)C2)C1
InChIInChI=1S/C17H23N3O2/c1-13(2)18-16(22)19-9-8-17(11-19)10-15(21)20(12-17)14-6-4-3-5-7-14/h3-7,13H,8-12H2,1-2H3,(H,18,22)
InChIKeyUGPIZVYJCXCQHL-UHFFFAOYSA-N
XLogP2.23
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-fluorophenyl)-3-oxo-N-phenyl-2,7-diazaspiro[4.4]nonane-7-carboxamide
CID 134073071
2-(3-methylphenyl)-3-oxo-N-phenyl-2,7-diazaspiro[4.4]nonane-7-carboxamide
CID 134070625
2-(4-methylphenyl)-7-(2-phenylacetyl)-2,7-diazaspiro[4.4]nonan-3-one
CID 134070621
7-(1-fluorocyclobutanecarbonyl)-2-(4-methylphenyl)-2,7-diazaspiro[4.4]nonan-3-one
CID 131682245
2-(3-methylphenyl)-7-(2-phenoxyacetyl)-2,7-diazaspiro[4.4]nonan-3-one
CID 131662035
1-benzyl-2-oxo-N-propan-2-yl-1,8-diazaspiro[4.5]decane-8-carboxamide
CID 97493909
7-(2-cyclopropylacetyl)-2-(4-methylphenyl)-2,7-diazaspiro[4.4]nonan-3-one
CID 131652638
7-(2-methoxyacetyl)-2-(4-methylphenyl)-2,7-diazaspiro[4.4]nonan-3-one
CID 134073060
4-[7-[2-(dimethylamino)acetyl]-3-oxo-2,7-diazaspiro[4.4]nonan-2-yl]benzonitrile
CID 134073075
7-(cyclopropanecarbonyl)-2-(4-methoxyphenyl)-2,7-diazaspiro[4.4]nonan-3-one
CID 131649039
8-methyl-N-[(1R)-1-(1-phenylpyrazol-4-yl)ethyl]-2,8-diazaspiro[4.5]decane-2-carboxamide
CID 126434651
7-[2-(dimethylamino)acetyl]-2-(3-methoxyphenyl)-2,7-diazaspiro[4.4]nonan-3-one;2,2,2-trifluoroacetic acid
CID 155854850

Frequently Asked Questions

What is the IUPAC name of 3-oxo-2-phenyl-N-propan-2-yl-2,7-diazaspiro[4.4]nonane-7-carboxamide?
The IUPAC name of 3-oxo-2-phenyl-N-propan-2-yl-2,7-diazaspiro[4.4]nonane-7-carboxamide (CID 118741086) is 3-oxo-2-phenyl-N-propan-2-yl-2,7-diazaspiro[4.4]nonane-7-carboxamide.
What is the SMILES notation for 3-oxo-2-phenyl-N-propan-2-yl-2,7-diazaspiro[4.4]nonane-7-carboxamide?
The canonical SMILES for 3-oxo-2-phenyl-N-propan-2-yl-2,7-diazaspiro[4.4]nonane-7-carboxamide is CC(C)NC(=O)N1CCC2(CC(=O)N(c3ccccc3)C2)C1.
What is the InChIKey of 3-oxo-2-phenyl-N-propan-2-yl-2,7-diazaspiro[4.4]nonane-7-carboxamide?
The InChIKey is UGPIZVYJCXCQHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O2/c1-13(2)18-16(22)19-9-8-17(11-19)10-15(21)20(12-17)14-6-4-3-5-7-14/h3-7,13H,8-12H2,1-2H3,(H,18,22).
What are the key properties of 3-oxo-2-phenyl-N-propan-2-yl-2,7-diazaspiro[4.4]nonane-7-carboxamide?
3-oxo-2-phenyl-N-propan-2-yl-2,7-diazaspiro[4.4]nonane-7-carboxamide has a molecular weight of 301.39 g/mol, XLogP of 2.23, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-oxo-2-phenyl-N-propan-2-yl-2,7-diazaspiro[4.4]nonane-7-carboxamide is sourced from PubChem (CID 118741086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).