N-cyclopentyl-2-(2,2-dimethylpropanoyl)-2-azaspiro[4.4]nonane-4-carboxamide

C19H32N2O2 — CID 71836623

IUPACN-cyclopentyl-2-(2,2-dimethylpropanoyl)-2-azaspiro[4.4]nonane-4-carboxamide
SMILESCC(C)(C)C(=O)N1CC(C(=O)NC2CCCC2)C2(CCCC2)C1
InChIInChI=1S/C19H32N2O2/c1-18(2,3)17(23)21-12-15(19(13-21)10-6-7-11-19)16(22)20-14-8-4-5-9-14/h14-15H,4-13H2,1-3H3,(H,20,22)
InChIKeyJOHLCIQDJHNANT-UHFFFAOYSA-N
MW320.48 g/mol
LogP3.11
Rot. Bonds2

About N-cyclopentyl-2-(2,2-dimethylpropanoyl)-2-azaspiro[4.4]nonane-4-carboxamide

N-cyclopentyl-2-(2,2-dimethylpropanoyl)-2-azaspiro[4.4]nonane-4-carboxamide (PubChem CID 71836623) has the molecular formula C19H32N2O2 and a molecular weight of 320.48 g/mol. Its IUPAC name is N-cyclopentyl-2-(2,2-dimethylpropanoyl)-2-azaspiro[4.4]nonane-4-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-2-(2,2-dimethylpropanoyl)-2-azaspiro[4.4]nonane-4-carboxamide
PubChem CID71836623
Molecular FormulaC19H32N2O2
Molecular Weight320.48 g/mol
Exact Mass320.25
IUPAC NameN-cyclopentyl-2-(2,2-dimethylpropanoyl)-2-azaspiro[4.4]nonane-4-carboxamide
SMILESCC(C)(C)C(=O)N1CC(C(=O)NC2CCCC2)C2(CCCC2)C1
InChIInChI=1S/C19H32N2O2/c1-18(2,3)17(23)21-12-15(19(13-21)10-6-7-11-19)16(22)20-14-8-4-5-9-14/h14-15H,4-13H2,1-3H3,(H,20,22)
InChIKeyJOHLCIQDJHNANT-UHFFFAOYSA-N
XLogP3.11
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.48
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-(2,2-dimethylpropanoyl)-2-azaspiro[4.4]nonane-4-carboxamide?
The IUPAC name of N-cyclopentyl-2-(2,2-dimethylpropanoyl)-2-azaspiro[4.4]nonane-4-carboxamide (CID 71836623) is N-cyclopentyl-2-(2,2-dimethylpropanoyl)-2-azaspiro[4.4]nonane-4-carboxamide.
What is the SMILES notation for N-cyclopentyl-2-(2,2-dimethylpropanoyl)-2-azaspiro[4.4]nonane-4-carboxamide?
The canonical SMILES for N-cyclopentyl-2-(2,2-dimethylpropanoyl)-2-azaspiro[4.4]nonane-4-carboxamide is CC(C)(C)C(=O)N1CC(C(=O)NC2CCCC2)C2(CCCC2)C1.
What is the InChIKey of N-cyclopentyl-2-(2,2-dimethylpropanoyl)-2-azaspiro[4.4]nonane-4-carboxamide?
The InChIKey is JOHLCIQDJHNANT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N2O2/c1-18(2,3)17(23)21-12-15(19(13-21)10-6-7-11-19)16(22)20-14-8-4-5-9-14/h14-15H,4-13H2,1-3H3,(H,20,22).
What are the key properties of N-cyclopentyl-2-(2,2-dimethylpropanoyl)-2-azaspiro[4.4]nonane-4-carboxamide?
N-cyclopentyl-2-(2,2-dimethylpropanoyl)-2-azaspiro[4.4]nonane-4-carboxamide has a molecular weight of 320.48 g/mol, XLogP of 3.11, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-(2,2-dimethylpropanoyl)-2-azaspiro[4.4]nonane-4-carboxamide is sourced from PubChem (CID 71836623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).