N-(2-methylcyclopentyl)-3,8-dioxa-11-azaspiro[5.6]dodecane-11-carboxamide

C16H28N2O3 — CID 127830794

IUPACN-(2-methylcyclopentyl)-3,8-dioxa-11-azaspiro[5.6]dodecane-11-carboxamide
SMILESCC1CCCC1NC(=O)N1CCOCC2(CCOCC2)C1
InChIInChI=1S/C16H28N2O3/c1-13-3-2-4-14(13)17-15(19)18-7-10-21-12-16(11-18)5-8-20-9-6-16/h13-14H,2-12H2,1H3,(H,17,19)
InChIKeyGLAMBSXLADCTTE-UHFFFAOYSA-N
MW296.41 g/mol
LogP2.01
Rot. Bonds1

About N-(2-methylcyclopentyl)-3,8-dioxa-11-azaspiro[5.6]dodecane-11-carboxamide

N-(2-methylcyclopentyl)-3,8-dioxa-11-azaspiro[5.6]dodecane-11-carboxamide (PubChem CID 127830794) has the molecular formula C16H28N2O3 and a molecular weight of 296.41 g/mol. Its IUPAC name is N-(2-methylcyclopentyl)-3,8-dioxa-11-azaspiro[5.6]dodecane-11-carboxamide.

Molecular Properties

Compound NameN-(2-methylcyclopentyl)-3,8-dioxa-11-azaspiro[5.6]dodecane-11-carboxamide
PubChem CID127830794
Molecular FormulaC16H28N2O3
Molecular Weight296.41 g/mol
Exact Mass296.21
IUPAC NameN-(2-methylcyclopentyl)-3,8-dioxa-11-azaspiro[5.6]dodecane-11-carboxamide
SMILESCC1CCCC1NC(=O)N1CCOCC2(CCOCC2)C1
InChIInChI=1S/C16H28N2O3/c1-13-3-2-4-14(13)17-15(19)18-7-10-21-12-16(11-18)5-8-20-9-6-16/h13-14H,2-12H2,1H3,(H,17,19)
InChIKeyGLAMBSXLADCTTE-UHFFFAOYSA-N
XLogP2.01
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methylcyclopentyl)morpholine-4-carboxamide
CID 115613523
N-(2-methyl-2,3-dihydro-1H-inden-1-yl)-3,8-dioxa-11-azaspiro[5.6]dodecane-11-carboxamide
CID 84600448
N-[(2S,4S)-2-cyclopropyloxan-4-yl]-3,8-dioxa-11-azaspiro[5.6]dodecane-11-carboxamide
CID 99714220
N-(2,2-diethylbutyl)-3,8-dioxa-11-azaspiro[5.6]dodecane-11-carboxamide
CID 86788762
N-(2-methylcycloheptyl)piperidine-1-carboxamide
CID 115665269
N-(1-phenylpiperidin-3-yl)-2-oxa-7-azaspiro[4.4]nonane-7-carboxamide
CID 71921021
N-[(1R,2S)-2-thiophen-3-ylcyclopropyl]-6-oxa-9-azaspiro[3.6]decane-9-carboxamide
CID 138030840
N-(3-fluoro-5-methylphenyl)-3,8-dioxa-11-azaspiro[5.6]dodecane-11-carboxamide
CID 99821838
N-[(2,2-dimethylcyclopropyl)methyl]-2-oxa-9-azaspiro[4.5]decane-9-carboxamide
CID 128608682
(5S)-N-[(2S)-1-cyclopropylbutan-2-yl]-2-oxa-7-azaspiro[4.4]nonane-7-carboxamide
CID 97223188
4-methyl-1-[(2-methylcyclohexyl)carbamoyl]pyrrolidine-3-carboxylic acid
CID 63722176
(5R)-N-[(1R,2R)-2-(3-chlorophenyl)cyclopropyl]-2-oxa-7-azaspiro[4.4]nonane-7-carboxamide
CID 99107522

Frequently Asked Questions

What is the IUPAC name of N-(2-methylcyclopentyl)-3,8-dioxa-11-azaspiro[5.6]dodecane-11-carboxamide?
The IUPAC name of N-(2-methylcyclopentyl)-3,8-dioxa-11-azaspiro[5.6]dodecane-11-carboxamide (CID 127830794) is N-(2-methylcyclopentyl)-3,8-dioxa-11-azaspiro[5.6]dodecane-11-carboxamide.
What is the SMILES notation for N-(2-methylcyclopentyl)-3,8-dioxa-11-azaspiro[5.6]dodecane-11-carboxamide?
The canonical SMILES for N-(2-methylcyclopentyl)-3,8-dioxa-11-azaspiro[5.6]dodecane-11-carboxamide is CC1CCCC1NC(=O)N1CCOCC2(CCOCC2)C1.
What is the InChIKey of N-(2-methylcyclopentyl)-3,8-dioxa-11-azaspiro[5.6]dodecane-11-carboxamide?
The InChIKey is GLAMBSXLADCTTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O3/c1-13-3-2-4-14(13)17-15(19)18-7-10-21-12-16(11-18)5-8-20-9-6-16/h13-14H,2-12H2,1H3,(H,17,19).
What are the key properties of N-(2-methylcyclopentyl)-3,8-dioxa-11-azaspiro[5.6]dodecane-11-carboxamide?
N-(2-methylcyclopentyl)-3,8-dioxa-11-azaspiro[5.6]dodecane-11-carboxamide has a molecular weight of 296.41 g/mol, XLogP of 2.01, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylcyclopentyl)-3,8-dioxa-11-azaspiro[5.6]dodecane-11-carboxamide is sourced from PubChem (CID 127830794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).