2-methyl-8-(2-piperidin-4-ylethyl)-2,8-diazaspiro[4.5]decan-1-one

C16H29N3O — CID 166113679

IUPAC2-methyl-8-(2-piperidin-4-ylethyl)-2,8-diazaspiro[4.5]decan-1-one
SMILESCN1CCC2(CCN(CCC3CCNCC3)CC2)C1=O
InChIInChI=1S/C16H29N3O/c1-18-11-5-16(15(18)20)6-12-19(13-7-16)10-4-14-2-8-17-9-3-14/h14,17H,2-13H2,1H3
InChIKeyVPEFZJDHCNBEOD-UHFFFAOYSA-N
MW279.43 g/mol
LogP1.32
Rot. Bonds3

About 2-methyl-8-(2-piperidin-4-ylethyl)-2,8-diazaspiro[4.5]decan-1-one

2-methyl-8-(2-piperidin-4-ylethyl)-2,8-diazaspiro[4.5]decan-1-one (PubChem CID 166113679) has the molecular formula C16H29N3O and a molecular weight of 279.43 g/mol. Its IUPAC name is 2-methyl-8-(2-piperidin-4-ylethyl)-2,8-diazaspiro[4.5]decan-1-one.

Molecular Properties

Compound Name2-methyl-8-(2-piperidin-4-ylethyl)-2,8-diazaspiro[4.5]decan-1-one
PubChem CID166113679
Molecular FormulaC16H29N3O
Molecular Weight279.43 g/mol
Exact Mass279.23
IUPAC Name2-methyl-8-(2-piperidin-4-ylethyl)-2,8-diazaspiro[4.5]decan-1-one
SMILESCN1CCC2(CCN(CCC3CCNCC3)CC2)C1=O
InChIInChI=1S/C16H29N3O/c1-18-11-5-16(15(18)20)6-12-19(13-7-16)10-4-14-2-8-17-9-3-14/h14,17H,2-13H2,1H3
InChIKeyVPEFZJDHCNBEOD-UHFFFAOYSA-N
XLogP1.32
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.43
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-8-(piperidin-4-ylmethyl)-2,8-diazaspiro[4.5]decan-1-one
CID 120849524
4,4-dimethyl-1-(2-piperidin-4-ylethyl)piperidine
CID 62937944
1-(2-piperidin-4-ylethyl)-1,4-diazepan-5-one
CID 105061114
tert-butyl 2-[9-(2-piperidin-4-ylethyl)-3,9-diazaspiro[5.5]undecan-3-yl]acetate
CID 22975802
2-methyl-9-piperidin-4-yl-2,9-diazaspiro[4.5]decan-1-one;dihydrochloride
CID 68666401
(5R)-2-methyl-2,7-diazaspiro[4.4]nonan-1-one
CID 124537264
1-(2-piperidin-4-ylethyl)-4-propan-2-ylpiperazine
CID 43585327
ethane;2-methyl-2,7-diazaspiro[4.4]nonan-1-one
CID 166077351
2-[9-(2-piperidin-4-ylethyl)-3,9-diazaspiro[5.5]undecan-3-yl]acetic acid;tris(2,2,2-trifluoroacetic acid)
CID 158970546
10-(2-piperidin-4-ylethyl)-3-propan-2-yl-7-oxa-3,10-diazaspiro[5.6]dodecane
CID 155702623
4-phenyl-1-(2-piperidin-4-ylethyl)piperidine
CID 68767972
1-cyclopropyl-4-(2-piperidin-4-ylethyl)piperazine;dihydrochloride
CID 120663613

Frequently Asked Questions

What is the IUPAC name of 2-methyl-8-(2-piperidin-4-ylethyl)-2,8-diazaspiro[4.5]decan-1-one?
The IUPAC name of 2-methyl-8-(2-piperidin-4-ylethyl)-2,8-diazaspiro[4.5]decan-1-one (CID 166113679) is 2-methyl-8-(2-piperidin-4-ylethyl)-2,8-diazaspiro[4.5]decan-1-one.
What is the SMILES notation for 2-methyl-8-(2-piperidin-4-ylethyl)-2,8-diazaspiro[4.5]decan-1-one?
The canonical SMILES for 2-methyl-8-(2-piperidin-4-ylethyl)-2,8-diazaspiro[4.5]decan-1-one is CN1CCC2(CCN(CCC3CCNCC3)CC2)C1=O.
What is the InChIKey of 2-methyl-8-(2-piperidin-4-ylethyl)-2,8-diazaspiro[4.5]decan-1-one?
The InChIKey is VPEFZJDHCNBEOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3O/c1-18-11-5-16(15(18)20)6-12-19(13-7-16)10-4-14-2-8-17-9-3-14/h14,17H,2-13H2,1H3.
What are the key properties of 2-methyl-8-(2-piperidin-4-ylethyl)-2,8-diazaspiro[4.5]decan-1-one?
2-methyl-8-(2-piperidin-4-ylethyl)-2,8-diazaspiro[4.5]decan-1-one has a molecular weight of 279.43 g/mol, XLogP of 1.32, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-8-(2-piperidin-4-ylethyl)-2,8-diazaspiro[4.5]decan-1-one is sourced from PubChem (CID 166113679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).