(5R)-9-(2-methoxyacetyl)-N-phenyl-2,9-diazaspiro[4.5]decane-2-carboxamide

C18H25N3O3 — CID 3232622

IUPAC(5R)-9-(2-methoxyacetyl)-N-phenyl-2,9-diazaspiro[4.5]decane-2-carboxamide
SMILESCOCC(=O)N1CCC[C@@]2(CCN(C(=O)Nc3ccccc3)C2)C1
InChIInChI=1S/C18H25N3O3/c1-24-12-16(22)20-10-5-8-18(13-20)9-11-21(14-18)17(23)19-15-6-3-2-4-7-15/h2-4,6-7H,5,8-14H2,1H3,(H,19,23)/t18-/m1/s1
InChIKeyCJFATHVFSJPDSL-GOSISDBHSA-N
MW331.42 g/mol
LogP2.18
Rot. Bonds3

About (5R)-9-(2-methoxyacetyl)-N-phenyl-2,9-diazaspiro[4.5]decane-2-carboxamide

(5R)-9-(2-methoxyacetyl)-N-phenyl-2,9-diazaspiro[4.5]decane-2-carboxamide (PubChem CID 3232622) has the molecular formula C18H25N3O3 and a molecular weight of 331.42 g/mol. Its IUPAC name is (5R)-9-(2-methoxyacetyl)-N-phenyl-2,9-diazaspiro[4.5]decane-2-carboxamide.

Molecular Properties

Compound Name(5R)-9-(2-methoxyacetyl)-N-phenyl-2,9-diazaspiro[4.5]decane-2-carboxamide
PubChem CID3232622
Molecular FormulaC18H25N3O3
Molecular Weight331.42 g/mol
Exact Mass331.19
IUPAC Name(5R)-9-(2-methoxyacetyl)-N-phenyl-2,9-diazaspiro[4.5]decane-2-carboxamide
SMILESCOCC(=O)N1CCC[C@@]2(CCN(C(=O)Nc3ccccc3)C2)C1
InChIInChI=1S/C18H25N3O3/c1-24-12-16(22)20-10-5-8-18(13-20)9-11-21(14-18)17(23)19-15-6-3-2-4-7-15/h2-4,6-7H,5,8-14H2,1H3,(H,19,23)/t18-/m1/s1
InChIKeyCJFATHVFSJPDSL-GOSISDBHSA-N
XLogP2.18
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (5R)-9-(2-methoxyacetyl)-N-phenyl-2,9-diazaspiro[4.5]decane-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (5R)-9-(2-methoxyacetyl)-N-phenyl-2,9-diazaspiro[4.5]decane-2-carboxamide?
The IUPAC name of (5R)-9-(2-methoxyacetyl)-N-phenyl-2,9-diazaspiro[4.5]decane-2-carboxamide (CID 3232622) is (5R)-9-(2-methoxyacetyl)-N-phenyl-2,9-diazaspiro[4.5]decane-2-carboxamide.
What is the SMILES notation for (5R)-9-(2-methoxyacetyl)-N-phenyl-2,9-diazaspiro[4.5]decane-2-carboxamide?
The canonical SMILES for (5R)-9-(2-methoxyacetyl)-N-phenyl-2,9-diazaspiro[4.5]decane-2-carboxamide is COCC(=O)N1CCC[C@@]2(CCN(C(=O)Nc3ccccc3)C2)C1.
What is the InChIKey of (5R)-9-(2-methoxyacetyl)-N-phenyl-2,9-diazaspiro[4.5]decane-2-carboxamide?
The InChIKey is CJFATHVFSJPDSL-GOSISDBHSA-N. The full InChI is InChI=1S/C18H25N3O3/c1-24-12-16(22)20-10-5-8-18(13-20)9-11-21(14-18)17(23)19-15-6-3-2-4-7-15/h2-4,6-7H,5,8-14H2,1H3,(H,19,23)/t18-/m1/s1.
What are the key properties of (5R)-9-(2-methoxyacetyl)-N-phenyl-2,9-diazaspiro[4.5]decane-2-carboxamide?
(5R)-9-(2-methoxyacetyl)-N-phenyl-2,9-diazaspiro[4.5]decane-2-carboxamide has a molecular weight of 331.42 g/mol, XLogP of 2.18, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-9-(2-methoxyacetyl)-N-phenyl-2,9-diazaspiro[4.5]decane-2-carboxamide is sourced from PubChem (CID 3232622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).