2-cyclohexyl-1-(2,8-diazaspiro[5.5]undecan-2-yl)ethanone

C17H30N2O — CID 102849929

IUPAC2-cyclohexyl-1-(2,8-diazaspiro[5.5]undecan-2-yl)ethanone
SMILESO=C(CC1CCCCC1)N1CCCC2(CCCNC2)C1
InChIInChI=1S/C17H30N2O/c20-16(12-15-6-2-1-3-7-15)19-11-5-9-17(14-19)8-4-10-18-13-17/h15,18H,1-14H2
InChIKeyYINADGYMZSPJPQ-UHFFFAOYSA-N
MW278.44 g/mol
LogP2.95
Rot. Bonds2

About 2-cyclohexyl-1-(2,8-diazaspiro[5.5]undecan-2-yl)ethanone

2-cyclohexyl-1-(2,8-diazaspiro[5.5]undecan-2-yl)ethanone (PubChem CID 102849929) has the molecular formula C17H30N2O and a molecular weight of 278.44 g/mol. Its IUPAC name is 2-cyclohexyl-1-(2,8-diazaspiro[5.5]undecan-2-yl)ethanone.

Molecular Properties

Compound Name2-cyclohexyl-1-(2,8-diazaspiro[5.5]undecan-2-yl)ethanone
PubChem CID102849929
Molecular FormulaC17H30N2O
Molecular Weight278.44 g/mol
Exact Mass278.24
IUPAC Name2-cyclohexyl-1-(2,8-diazaspiro[5.5]undecan-2-yl)ethanone
SMILESO=C(CC1CCCCC1)N1CCCC2(CCCNC2)C1
InChIInChI=1S/C17H30N2O/c20-16(12-15-6-2-1-3-7-15)19-11-5-9-17(14-19)8-4-10-18-13-17/h15,18H,1-14H2
InChIKeyYINADGYMZSPJPQ-UHFFFAOYSA-N
XLogP2.95
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.44
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-cyclopentyl-1-(2,8-diazaspiro[5.5]undecan-2-yl)propan-1-one
CID 102849644
1-(2,8-diazaspiro[5.5]undecan-2-yl)-2-(oxan-2-yl)ethanone
CID 102849816
1-(2,8-diazaspiro[5.5]undecan-2-yl)butane-1,3-dione
CID 110460606
1-(2,8-diazaspiro[5.5]undecan-2-yl)-3-methylbutan-1-one
CID 82038247
cyclobutyl(2,8-diazaspiro[5.5]undecan-2-yl)methanone
CID 102849782
1-(2,8-diazaspiro[5.5]undecan-2-yl)-3-methoxypropan-1-one
CID 82038245
1-(2,8-diazaspiro[5.5]undecan-2-yl)-2-ethoxyethanone
CID 102849595
2-cyclopentyl-1-(1-oxa-4,8-diazaspiro[5.5]undecan-4-yl)ethanone;hydrochloride
CID 155856169
2,8-diazaspiro[5.5]undecan-2-yl-(2,2-dimethylcyclohexyl)methanone
CID 107181114
1-(3-azaspiro[5.5]undecan-3-yl)-2-piperidin-3-ylethanone
CID 62932288
1-(2,8-diazaspiro[5.5]undecan-2-yl)-2-(4-hydroxyphenyl)ethanone
CID 82038156
2,8-diazaspiro[5.5]undecan-2-yl-(1-methylpyrrolidin-3-yl)methanone
CID 102849661

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-1-(2,8-diazaspiro[5.5]undecan-2-yl)ethanone?
The IUPAC name of 2-cyclohexyl-1-(2,8-diazaspiro[5.5]undecan-2-yl)ethanone (CID 102849929) is 2-cyclohexyl-1-(2,8-diazaspiro[5.5]undecan-2-yl)ethanone.
What is the SMILES notation for 2-cyclohexyl-1-(2,8-diazaspiro[5.5]undecan-2-yl)ethanone?
The canonical SMILES for 2-cyclohexyl-1-(2,8-diazaspiro[5.5]undecan-2-yl)ethanone is O=C(CC1CCCCC1)N1CCCC2(CCCNC2)C1.
What is the InChIKey of 2-cyclohexyl-1-(2,8-diazaspiro[5.5]undecan-2-yl)ethanone?
The InChIKey is YINADGYMZSPJPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O/c20-16(12-15-6-2-1-3-7-15)19-11-5-9-17(14-19)8-4-10-18-13-17/h15,18H,1-14H2.
What are the key properties of 2-cyclohexyl-1-(2,8-diazaspiro[5.5]undecan-2-yl)ethanone?
2-cyclohexyl-1-(2,8-diazaspiro[5.5]undecan-2-yl)ethanone has a molecular weight of 278.44 g/mol, XLogP of 2.95, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-1-(2,8-diazaspiro[5.5]undecan-2-yl)ethanone is sourced from PubChem (CID 102849929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).