2-azaspiro[5.5]undecan-2-yl(cyclohexyl)methanone

C17H29NO — CID 54583941

IUPAC2-azaspiro[5.5]undecan-2-yl(cyclohexyl)methanone
SMILESO=C(C1CCCCC1)N1CCCC2(CCCCC2)C1
InChIInChI=1S/C17H29NO/c19-16(15-8-3-1-4-9-15)18-13-7-12-17(14-18)10-5-2-6-11-17/h15H,1-14H2
InChIKeyOYZGBVMJCNJHEN-UHFFFAOYSA-N
MW263.42 g/mol
LogP4.14
Rot. Bonds1

About 2-azaspiro[5.5]undecan-2-yl(cyclohexyl)methanone

2-azaspiro[5.5]undecan-2-yl(cyclohexyl)methanone (PubChem CID 54583941) has the molecular formula C17H29NO and a molecular weight of 263.42 g/mol. Its IUPAC name is 2-azaspiro[5.5]undecan-2-yl(cyclohexyl)methanone.

Molecular Properties

Compound Name2-azaspiro[5.5]undecan-2-yl(cyclohexyl)methanone
PubChem CID54583941
Molecular FormulaC17H29NO
Molecular Weight263.42 g/mol
Exact Mass263.22
IUPAC Name2-azaspiro[5.5]undecan-2-yl(cyclohexyl)methanone
SMILESO=C(C1CCCCC1)N1CCCC2(CCCCC2)C1
InChIInChI=1S/C17H29NO/c19-16(15-8-3-1-4-9-15)18-13-7-12-17(14-18)10-5-2-6-11-17/h15H,1-14H2
InChIKeyOYZGBVMJCNJHEN-UHFFFAOYSA-N
XLogP4.14
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.42
LogP ≤ 54.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 235809
Adamantan-1-yl-(4-methyl-piperazin-1-yl)-methanone
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Cyclohexyl(4-cyclohexylpiperazin-1-yl)methanone
CID 17249078
N,N-Diisopropyl-1-adamantanecarboxamide
CID 369222
2-Cyclobutanecarbonyl-2-azaspiro[5.5]undecane
CID 54582001
2-(Adamantan-1-yl)-1-(4-ethylpiperazin-1-yl)ethan-1-one
CID 25236186
Piperidine, 1-(cyclohexylcarbonyl)-3-methyl-
CID 2915080
1-(1-Adamantylacetyl)pyrrolidine
CID 2835983
1-(1-Adamantylacetyl)-4-methylpiperazine
CID 2876347
1-(4-Tert-butylcyclohexanecarbonyl)-4-ethylpiperazine
CID 36054265

Frequently Asked Questions

What is the IUPAC name of 2-azaspiro[5.5]undecan-2-yl(cyclohexyl)methanone?
The IUPAC name of 2-azaspiro[5.5]undecan-2-yl(cyclohexyl)methanone (CID 54583941) is 2-azaspiro[5.5]undecan-2-yl(cyclohexyl)methanone.
What is the SMILES notation for 2-azaspiro[5.5]undecan-2-yl(cyclohexyl)methanone?
The canonical SMILES for 2-azaspiro[5.5]undecan-2-yl(cyclohexyl)methanone is O=C(C1CCCCC1)N1CCCC2(CCCCC2)C1.
What is the InChIKey of 2-azaspiro[5.5]undecan-2-yl(cyclohexyl)methanone?
The InChIKey is OYZGBVMJCNJHEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29NO/c19-16(15-8-3-1-4-9-15)18-13-7-12-17(14-18)10-5-2-6-11-17/h15H,1-14H2.
What are the key properties of 2-azaspiro[5.5]undecan-2-yl(cyclohexyl)methanone?
2-azaspiro[5.5]undecan-2-yl(cyclohexyl)methanone has a molecular weight of 263.42 g/mol, XLogP of 4.14, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-azaspiro[5.5]undecan-2-yl(cyclohexyl)methanone is sourced from PubChem (CID 54583941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).