8-(cyclopropylmethyl)-2-(2-methylpropyl)-2,8-diazaspiro[4.5]decan-1-one

C16H28N2O — CID 97370172

IUPAC8-(cyclopropylmethyl)-2-(2-methylpropyl)-2,8-diazaspiro[4.5]decan-1-one
SMILESCC(C)CN1CCC2(CCN(CC3CC3)CC2)C1=O
InChIInChI=1S/C16H28N2O/c1-13(2)11-18-10-7-16(15(18)19)5-8-17(9-6-16)12-14-3-4-14/h13-14H,3-12H2,1-2H3
InChIKeyVKLGIIBIMJBTFN-UHFFFAOYSA-N
MW264.41 g/mol
LogP2.37
Rot. Bonds4

About 8-(cyclopropylmethyl)-2-(2-methylpropyl)-2,8-diazaspiro[4.5]decan-1-one

8-(cyclopropylmethyl)-2-(2-methylpropyl)-2,8-diazaspiro[4.5]decan-1-one (PubChem CID 97370172) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is 8-(cyclopropylmethyl)-2-(2-methylpropyl)-2,8-diazaspiro[4.5]decan-1-one.

Molecular Properties

Compound Name8-(cyclopropylmethyl)-2-(2-methylpropyl)-2,8-diazaspiro[4.5]decan-1-one
PubChem CID97370172
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC Name8-(cyclopropylmethyl)-2-(2-methylpropyl)-2,8-diazaspiro[4.5]decan-1-one
SMILESCC(C)CN1CCC2(CCN(CC3CC3)CC2)C1=O
InChIInChI=1S/C16H28N2O/c1-13(2)11-18-10-7-16(15(18)19)5-8-17(9-6-16)12-14-3-4-14/h13-14H,3-12H2,1-2H3
InChIKeyVKLGIIBIMJBTFN-UHFFFAOYSA-N
XLogP2.37
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
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

8-(Cyclopropylmethyl)-2-methyl-2,8-diazaspiro[4.5]decan-1-one
CID 97370119
8-(Cyclopropylmethyl)-2-(2-methoxyethyl)-2,8-diazaspiro[4.5]decan-1-one
CID 97370196
2-[8-(cyclopropylmethyl)-1-oxo-2,8-diazaspiro[4.5]decan-2-yl]-N,N-dimethylacetamide
CID 97370256
2,8-Bis(cyclopropylmethyl)-2,8-diazaspiro[4.5]decan-1-one
CID 97370280
Cambridge id 6579802
CID 883948
1-[4-(Pyrrolidin-1-ylcarbonyl)piperidin-1-yl]butan-1-one
CID 44141336
2-cyclopropyl-N,2-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]propanamide
CID 126799145
2-(2-Fluoroethyl)-8-methyl-2,8-diazaspiro[4.5]decan-3-one
CID 123532993
1-[6-(Fluoromethyl)-3-azabicyclo[3.1.0]hexan-3-yl]-2,2-dimethylpropan-1-one
CID 126750466
2,2-Dimethyl-1-[4-(pyrrolidine-1-carbonyl)-4-(trifluoromethyl)piperidin-1-yl]propan-1-one
CID 126750473
Ethane;2-methyl-1-[2-(3,3,3-trifluoropropyl)-2,8-diazaspiro[4.5]decan-8-yl]propan-1-one
CID 145287213
1-[4,4-Difluoro-2-(2-methylpropyl)-2,8-diazaspiro[4.5]decan-8-yl]-2-methylpropan-1-one
CID 176559240

Frequently Asked Questions

What is the IUPAC name of 8-(cyclopropylmethyl)-2-(2-methylpropyl)-2,8-diazaspiro[4.5]decan-1-one?
The IUPAC name of 8-(cyclopropylmethyl)-2-(2-methylpropyl)-2,8-diazaspiro[4.5]decan-1-one (CID 97370172) is 8-(cyclopropylmethyl)-2-(2-methylpropyl)-2,8-diazaspiro[4.5]decan-1-one.
What is the SMILES notation for 8-(cyclopropylmethyl)-2-(2-methylpropyl)-2,8-diazaspiro[4.5]decan-1-one?
The canonical SMILES for 8-(cyclopropylmethyl)-2-(2-methylpropyl)-2,8-diazaspiro[4.5]decan-1-one is CC(C)CN1CCC2(CCN(CC3CC3)CC2)C1=O.
What is the InChIKey of 8-(cyclopropylmethyl)-2-(2-methylpropyl)-2,8-diazaspiro[4.5]decan-1-one?
The InChIKey is VKLGIIBIMJBTFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O/c1-13(2)11-18-10-7-16(15(18)19)5-8-17(9-6-16)12-14-3-4-14/h13-14H,3-12H2,1-2H3.
What are the key properties of 8-(cyclopropylmethyl)-2-(2-methylpropyl)-2,8-diazaspiro[4.5]decan-1-one?
8-(cyclopropylmethyl)-2-(2-methylpropyl)-2,8-diazaspiro[4.5]decan-1-one has a molecular weight of 264.41 g/mol, XLogP of 2.37, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(cyclopropylmethyl)-2-(2-methylpropyl)-2,8-diazaspiro[4.5]decan-1-one is sourced from PubChem (CID 97370172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).