(7-methyl-7-azaspiro[3.5]nonan-2-yl)-(4-methylpiperidin-1-yl)methanone

C16H28N2O — CID 169257517

IUPAC(7-methyl-7-azaspiro[3.5]nonan-2-yl)-(4-methylpiperidin-1-yl)methanone
SMILESCC1CCN(C(=O)C2CC3(CCN(C)CC3)C2)CC1
InChIInChI=1S/C16H28N2O/c1-13-3-7-18(8-4-13)15(19)14-11-16(12-14)5-9-17(2)10-6-16/h13-14H,3-12H2,1-2H3
InChIKeyWERVBKGSIXOXBK-UHFFFAOYSA-N
MW264.41 g/mol
LogP2.37
Rot. Bonds1

About (7-methyl-7-azaspiro[3.5]nonan-2-yl)-(4-methylpiperidin-1-yl)methanone

(7-methyl-7-azaspiro[3.5]nonan-2-yl)-(4-methylpiperidin-1-yl)methanone (PubChem CID 169257517) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is (7-methyl-7-azaspiro[3.5]nonan-2-yl)-(4-methylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(7-methyl-7-azaspiro[3.5]nonan-2-yl)-(4-methylpiperidin-1-yl)methanone
PubChem CID169257517
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC Name(7-methyl-7-azaspiro[3.5]nonan-2-yl)-(4-methylpiperidin-1-yl)methanone
SMILESCC1CCN(C(=O)C2CC3(CCN(C)CC3)C2)CC1
InChIInChI=1S/C16H28N2O/c1-13-3-7-18(8-4-13)15(19)14-11-16(12-14)5-9-17(2)10-6-16/h13-14H,3-12H2,1-2H3
InChIKeyWERVBKGSIXOXBK-UHFFFAOYSA-N
XLogP2.37
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(5S)-2,9-dimethyl-5-(trifluoromethyl)-2,9-diazaspiro[5.5]undecan-3-one
CID 97406882
Cyclobutyl-[9-[2-(dimethylamino)ethyl]-2,9-diazaspiro[5.5]undecan-2-yl]methanone
CID 97484542
1,6-Bis(4-methylpiperidin-1-yl)hexane-1,6-dione
CID 4990135
1-[(1S,5S)-6,6-dimethyl-3-azabicyclo[3.1.1]heptan-3-yl]-2-(1-fluorocyclopropyl)ethanone
CID 169655720
3-[1-(2,2-Dimethylpropanoyl)piperidin-4-yl]-2,2-dimethyl-1-[4-(trifluoromethyl)piperidin-1-yl]propan-1-one
CID 169874807
1-[2-Fluoro-2-[[4-(2-methylpropyl)piperazin-1-yl]methyl]-7-azaspiro[3.5]nonan-7-yl]-2-methylpropan-1-one
CID 176558227
1-[2-[[3,3-Difluoro-4-(2-methylpropyl)piperidin-1-yl]methyl]-7-azaspiro[3.5]nonan-7-yl]propan-1-one
CID 176558657
1-(1''-Methyl-[4,4'']bipiperidinyl-1-yl)-pentadecan-1-one; hydrochloride
CID 11546731
1-{4-[2-(1-Methyl-piperidin-4-yl)-ethyl]-piperidin-1-yl}-pentadecan-1-one; hydrochloride
CID 11576427
1-(1''-Methyl-[4,4'']bipiperidinyl-1-yl)-heptadecan-1-one; hydrochloride
CID 11648485
1-[4-(1-Methylpiperidin-4-yl)piperidin-1-yl]tridecan-1-one
CID 11704361
[4-Methyl-4-(2-methylpropyl)piperidin-1-yl]-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]methanone
CID 126816255

Frequently Asked Questions

What is the IUPAC name of (7-methyl-7-azaspiro[3.5]nonan-2-yl)-(4-methylpiperidin-1-yl)methanone?
The IUPAC name of (7-methyl-7-azaspiro[3.5]nonan-2-yl)-(4-methylpiperidin-1-yl)methanone (CID 169257517) is (7-methyl-7-azaspiro[3.5]nonan-2-yl)-(4-methylpiperidin-1-yl)methanone.
What is the SMILES notation for (7-methyl-7-azaspiro[3.5]nonan-2-yl)-(4-methylpiperidin-1-yl)methanone?
The canonical SMILES for (7-methyl-7-azaspiro[3.5]nonan-2-yl)-(4-methylpiperidin-1-yl)methanone is CC1CCN(C(=O)C2CC3(CCN(C)CC3)C2)CC1.
What is the InChIKey of (7-methyl-7-azaspiro[3.5]nonan-2-yl)-(4-methylpiperidin-1-yl)methanone?
The InChIKey is WERVBKGSIXOXBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O/c1-13-3-7-18(8-4-13)15(19)14-11-16(12-14)5-9-17(2)10-6-16/h13-14H,3-12H2,1-2H3.
What are the key properties of (7-methyl-7-azaspiro[3.5]nonan-2-yl)-(4-methylpiperidin-1-yl)methanone?
(7-methyl-7-azaspiro[3.5]nonan-2-yl)-(4-methylpiperidin-1-yl)methanone has a molecular weight of 264.41 g/mol, XLogP of 2.37, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (7-methyl-7-azaspiro[3.5]nonan-2-yl)-(4-methylpiperidin-1-yl)methanone is sourced from PubChem (CID 169257517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).