N-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide

C16H28N2O — CID 115605548

IUPACN-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide
SMILESO=C(NC1CCCC1)N1CCC2(CCCCC2)CC1
InChIInChI=1S/C16H28N2O/c19-15(17-14-6-2-3-7-14)18-12-10-16(11-13-18)8-4-1-5-9-16/h14H,1-13H2,(H,17,19)
InChIKeyHRMNDRVCCQDSRP-UHFFFAOYSA-N
MW264.41 g/mol
LogP3.68
Rot. Bonds1

About N-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide

N-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide (PubChem CID 115605548) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is N-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide
PubChem CID115605548
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC NameN-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide
SMILESO=C(NC1CCCC1)N1CCC2(CCCCC2)CC1
InChIInChI=1S/C16H28N2O/c19-15(17-14-6-2-3-7-14)18-12-10-16(11-13-18)8-4-1-5-9-16/h14H,1-13H2,(H,17,19)
InChIKeyHRMNDRVCCQDSRP-UHFFFAOYSA-N
XLogP3.68
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide?
The IUPAC name of N-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide (CID 115605548) is N-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide.
What is the SMILES notation for N-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide?
The canonical SMILES for N-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide is O=C(NC1CCCC1)N1CCC2(CCCCC2)CC1.
What is the InChIKey of N-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide?
The InChIKey is HRMNDRVCCQDSRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O/c19-15(17-14-6-2-3-7-14)18-12-10-16(11-13-18)8-4-1-5-9-16/h14H,1-13H2,(H,17,19).
What are the key properties of N-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide?
N-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide has a molecular weight of 264.41 g/mol, XLogP of 3.68, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-azaspiro[5.5]undecane-3-carboxamide is sourced from PubChem (CID 115605548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).