1-(2-pyrrolidin-1-ylethyl)-1,3-diazaspiro[4.5]decane-2,4-dione

C14H23N3O2 — CID 107914237

IUPAC1-(2-pyrrolidin-1-ylethyl)-1,3-diazaspiro[4.5]decane-2,4-dione
SMILESO=C1NC(=O)C2(CCCCC2)N1CCN1CCCC1
InChIInChI=1S/C14H23N3O2/c18-12-14(6-2-1-3-7-14)17(13(19)15-12)11-10-16-8-4-5-9-16/h1-11H2,(H,15,18,19)
InChIKeyZGYPPVRXZRVLRP-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.34
Rot. Bonds3

About 1-(2-pyrrolidin-1-ylethyl)-1,3-diazaspiro[4.5]decane-2,4-dione

1-(2-pyrrolidin-1-ylethyl)-1,3-diazaspiro[4.5]decane-2,4-dione (PubChem CID 107914237) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is 1-(2-pyrrolidin-1-ylethyl)-1,3-diazaspiro[4.5]decane-2,4-dione.

Molecular Properties

Compound Name1-(2-pyrrolidin-1-ylethyl)-1,3-diazaspiro[4.5]decane-2,4-dione
PubChem CID107914237
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name1-(2-pyrrolidin-1-ylethyl)-1,3-diazaspiro[4.5]decane-2,4-dione
SMILESO=C1NC(=O)C2(CCCCC2)N1CCN1CCCC1
InChIInChI=1S/C14H23N3O2/c18-12-14(6-2-1-3-7-14)17(13(19)15-12)11-10-16-8-4-5-9-16/h1-11H2,(H,15,18,19)
InChIKeyZGYPPVRXZRVLRP-UHFFFAOYSA-N
XLogP1.34
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

1-(chloromethyl)-1,3-diazaspiro[4.5]decane-2,4-dione
CID 130008709
1-(4-methylpentyl)-1,3-diazaspiro[4.6]undecane-2,4-dione
CID 83168970
1-(2-ethylsulfanylethyl)-1,3-diazaspiro[4.6]undecane-2,4-dione
CID 113474380
1-(4-methoxybutyl)-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 113437173
1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 104567461
1-[3-(oxolan-2-yl)propyl]-1,3-diazaspiro[4.6]undecane-2,4-dione
CID 65165016
8-(2-pyrrolidin-1-ylethyl)-6,8-diazaspiro[3.5]nonane-5,7,9-trione
CID 112600452
3-(2-piperidin-1-ylethyl)-1,3-diazaspiro[4.4]nonan-4-one
CID 83246101
1-(2-piperidin-1-ylethyl)imidazolidine-2,4-dione
CID 173227348
1-(2-pyrrolidin-1-ylethyl)pyrrolidine
CID 11062806
2-methyl-3-(2-piperidin-1-ylethyl)-1,3-diazaspiro[4.4]nonan-4-one
CID 83244839
4-imino-1,9-dipropyl-1,3,9-triazaspiro[4.6]undecan-2-one
CID 138389584

Frequently Asked Questions

What is the IUPAC name of 1-(2-pyrrolidin-1-ylethyl)-1,3-diazaspiro[4.5]decane-2,4-dione?
The IUPAC name of 1-(2-pyrrolidin-1-ylethyl)-1,3-diazaspiro[4.5]decane-2,4-dione (CID 107914237) is 1-(2-pyrrolidin-1-ylethyl)-1,3-diazaspiro[4.5]decane-2,4-dione.
What is the SMILES notation for 1-(2-pyrrolidin-1-ylethyl)-1,3-diazaspiro[4.5]decane-2,4-dione?
The canonical SMILES for 1-(2-pyrrolidin-1-ylethyl)-1,3-diazaspiro[4.5]decane-2,4-dione is O=C1NC(=O)C2(CCCCC2)N1CCN1CCCC1.
What is the InChIKey of 1-(2-pyrrolidin-1-ylethyl)-1,3-diazaspiro[4.5]decane-2,4-dione?
The InChIKey is ZGYPPVRXZRVLRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c18-12-14(6-2-1-3-7-14)17(13(19)15-12)11-10-16-8-4-5-9-16/h1-11H2,(H,15,18,19).
What are the key properties of 1-(2-pyrrolidin-1-ylethyl)-1,3-diazaspiro[4.5]decane-2,4-dione?
1-(2-pyrrolidin-1-ylethyl)-1,3-diazaspiro[4.5]decane-2,4-dione has a molecular weight of 265.36 g/mol, XLogP of 1.34, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-pyrrolidin-1-ylethyl)-1,3-diazaspiro[4.5]decane-2,4-dione is sourced from PubChem (CID 107914237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).