5-[2-(2-cyclopropyl-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl)-2-oxoethyl]-1H-pyrimidine-2,4-dione

C18H24N4O4 — CID 72861923

IUPAC5-[2-(2-cyclopropyl-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl)-2-oxoethyl]-1H-pyrimidine-2,4-dione
SMILESO=C(Cc1c[nH]c(=O)[nH]c1=O)N1CCC2(CCC(=O)N(C3CC3)C2)CC1
InChIInChI=1S/C18H24N4O4/c23-14-3-4-18(11-22(14)13-1-2-13)5-7-21(8-6-18)15(24)9-12-10-19-17(26)20-16(12)25/h10,13H,1-9,11H2,(H2,19,20,25,26)
InChIKeyBHPLDTXNJKZHJM-UHFFFAOYSA-N
MW360.41 g/mol
LogP-0.00
Rot. Bonds3

About 5-[2-(2-cyclopropyl-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl)-2-oxoethyl]-1H-pyrimidine-2,4-dione

5-[2-(2-cyclopropyl-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl)-2-oxoethyl]-1H-pyrimidine-2,4-dione (PubChem CID 72861923) has the molecular formula C18H24N4O4 and a molecular weight of 360.41 g/mol. Its IUPAC name is 5-[2-(2-cyclopropyl-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl)-2-oxoethyl]-1H-pyrimidine-2,4-dione.

Molecular Properties

Compound Name5-[2-(2-cyclopropyl-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl)-2-oxoethyl]-1H-pyrimidine-2,4-dione
PubChem CID72861923
Molecular FormulaC18H24N4O4
Molecular Weight360.41 g/mol
Exact Mass360.18
IUPAC Name5-[2-(2-cyclopropyl-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl)-2-oxoethyl]-1H-pyrimidine-2,4-dione
SMILESO=C(Cc1c[nH]c(=O)[nH]c1=O)N1CCC2(CCC(=O)N(C3CC3)C2)CC1
InChIInChI=1S/C18H24N4O4/c23-14-3-4-18(11-22(14)13-1-2-13)5-7-21(8-6-18)15(24)9-12-10-19-17(26)20-16(12)25/h10,13H,1-9,11H2,(H2,19,20,25,26)
InChIKeyBHPLDTXNJKZHJM-UHFFFAOYSA-N
XLogP-0.00
TPSA106.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.41
LogP ≤ 5-0.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-[2-(2-cyclopropyl-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl)-2-oxoethyl]-1H-pyrimidine-2,4-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-[2-(2-cyclopropyl-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl)-2-oxoethyl]-1H-pyrimidine-2,4-dione?
The IUPAC name of 5-[2-(2-cyclopropyl-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl)-2-oxoethyl]-1H-pyrimidine-2,4-dione (CID 72861923) is 5-[2-(2-cyclopropyl-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl)-2-oxoethyl]-1H-pyrimidine-2,4-dione.
What is the SMILES notation for 5-[2-(2-cyclopropyl-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl)-2-oxoethyl]-1H-pyrimidine-2,4-dione?
The canonical SMILES for 5-[2-(2-cyclopropyl-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl)-2-oxoethyl]-1H-pyrimidine-2,4-dione is O=C(Cc1c[nH]c(=O)[nH]c1=O)N1CCC2(CCC(=O)N(C3CC3)C2)CC1.
What is the InChIKey of 5-[2-(2-cyclopropyl-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl)-2-oxoethyl]-1H-pyrimidine-2,4-dione?
The InChIKey is BHPLDTXNJKZHJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O4/c23-14-3-4-18(11-22(14)13-1-2-13)5-7-21(8-6-18)15(24)9-12-10-19-17(26)20-16(12)25/h10,13H,1-9,11H2,(H2,19,20,25,26).
What are the key properties of 5-[2-(2-cyclopropyl-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl)-2-oxoethyl]-1H-pyrimidine-2,4-dione?
5-[2-(2-cyclopropyl-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl)-2-oxoethyl]-1H-pyrimidine-2,4-dione has a molecular weight of 360.41 g/mol, XLogP of -0.00, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(2-cyclopropyl-3-oxo-2,9-diazaspiro[5.5]undecan-9-yl)-2-oxoethyl]-1H-pyrimidine-2,4-dione is sourced from PubChem (CID 72861923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).