6-(cyclopentylmethyl)-5-propyl-4,6-diazaspiro[2.4]heptan-7-one

C14H24N2O — CID 83244163

IUPAC6-(cyclopentylmethyl)-5-propyl-4,6-diazaspiro[2.4]heptan-7-one
SMILESCCCC1NC2(CC2)C(=O)N1CC1CCCC1
InChIInChI=1S/C14H24N2O/c1-2-5-12-15-14(8-9-14)13(17)16(12)10-11-6-3-4-7-11/h11-12,15H,2-10H2,1H3
InChIKeyVZZKSZADMXPEFA-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.27
Rot. Bonds4

About 6-(cyclopentylmethyl)-5-propyl-4,6-diazaspiro[2.4]heptan-7-one

6-(cyclopentylmethyl)-5-propyl-4,6-diazaspiro[2.4]heptan-7-one (PubChem CID 83244163) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 6-(cyclopentylmethyl)-5-propyl-4,6-diazaspiro[2.4]heptan-7-one.

Molecular Properties

Compound Name6-(cyclopentylmethyl)-5-propyl-4,6-diazaspiro[2.4]heptan-7-one
PubChem CID83244163
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name6-(cyclopentylmethyl)-5-propyl-4,6-diazaspiro[2.4]heptan-7-one
SMILESCCCC1NC2(CC2)C(=O)N1CC1CCCC1
InChIInChI=1S/C14H24N2O/c1-2-5-12-15-14(8-9-14)13(17)16(12)10-11-6-3-4-7-11/h11-12,15H,2-10H2,1H3
InChIKeyVZZKSZADMXPEFA-UHFFFAOYSA-N
XLogP2.27
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(1-methylpiperidin-4-yl)methyl]-2-propyl-1,3-diazaspiro[4.4]nonan-4-one
CID 83253627
5-propyl-6-(thiolan-2-ylmethyl)-4,6-diazaspiro[2.4]heptan-7-one
CID 83270353
5-ethyl-6-[(1-methylpiperidin-4-yl)methyl]-4,6-diazaspiro[2.4]heptan-7-one
CID 83249122
6-(2-cyclohexyloxyethyl)-5-propyl-4,6-diazaspiro[2.4]heptan-7-one
CID 83264366
6-(2-methylpropyl)-5-propyl-4,6-diazaspiro[2.4]heptan-7-one
CID 83242401
3-(2-cyclopentyloxyethyl)-2-propyl-1,3-diazaspiro[4.4]nonan-4-one
CID 83264491
5-propyl-6-(3,3,3-trifluoropropyl)-4,6-diazaspiro[2.4]heptan-7-one
CID 83254359
6-[2-[ethyl(methyl)amino]ethyl]-5-propyl-4,6-diazaspiro[2.4]heptan-7-one
CID 83255546
6-(4-methylpentyl)-5-propyl-4,6-diazaspiro[2.4]heptan-7-one
CID 83258164
6-(2,2-dimethylcyclohexyl)-5-propyl-4,6-diazaspiro[2.4]heptan-7-one
CID 83270898
3-(2-methylsulfonylethyl)-2-propyl-1,3-diazaspiro[4.4]nonan-4-one
CID 83256534
2-ethyl-3-(thiolan-3-ylmethyl)-1,3-diazaspiro[4.4]nonan-4-one
CID 107299046

Frequently Asked Questions

What is the IUPAC name of 6-(cyclopentylmethyl)-5-propyl-4,6-diazaspiro[2.4]heptan-7-one?
The IUPAC name of 6-(cyclopentylmethyl)-5-propyl-4,6-diazaspiro[2.4]heptan-7-one (CID 83244163) is 6-(cyclopentylmethyl)-5-propyl-4,6-diazaspiro[2.4]heptan-7-one.
What is the SMILES notation for 6-(cyclopentylmethyl)-5-propyl-4,6-diazaspiro[2.4]heptan-7-one?
The canonical SMILES for 6-(cyclopentylmethyl)-5-propyl-4,6-diazaspiro[2.4]heptan-7-one is CCCC1NC2(CC2)C(=O)N1CC1CCCC1.
What is the InChIKey of 6-(cyclopentylmethyl)-5-propyl-4,6-diazaspiro[2.4]heptan-7-one?
The InChIKey is VZZKSZADMXPEFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-2-5-12-15-14(8-9-14)13(17)16(12)10-11-6-3-4-7-11/h11-12,15H,2-10H2,1H3.
What are the key properties of 6-(cyclopentylmethyl)-5-propyl-4,6-diazaspiro[2.4]heptan-7-one?
6-(cyclopentylmethyl)-5-propyl-4,6-diazaspiro[2.4]heptan-7-one has a molecular weight of 236.36 g/mol, XLogP of 2.27, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclopentylmethyl)-5-propyl-4,6-diazaspiro[2.4]heptan-7-one is sourced from PubChem (CID 83244163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).