3-[3-[3,5-dimethyl-4-(4-methylmorpholin-3-yl)pyrazol-1-yl]propyl]imidazolidine-2,4-dione

C16H25N5O3 — CID 167991701

IUPAC3-[3-[3,5-dimethyl-4-(4-methylmorpholin-3-yl)pyrazol-1-yl]propyl]imidazolidine-2,4-dione
SMILESCc1nn(CCCN2C(=O)CNC2=O)c(C)c1C1COCCN1C
InChIInChI=1S/C16H25N5O3/c1-11-15(13-10-24-8-7-19(13)3)12(2)21(18-11)6-4-5-20-14(22)9-17-16(20)23/h13H,4-10H2,1-3H3,(H,17,23)
InChIKeyBOOSKGXJYNQCLF-UHFFFAOYSA-N
MW335.41 g/mol
LogP0.44
Rot. Bonds5

About 3-[3-[3,5-dimethyl-4-(4-methylmorpholin-3-yl)pyrazol-1-yl]propyl]imidazolidine-2,4-dione

3-[3-[3,5-dimethyl-4-(4-methylmorpholin-3-yl)pyrazol-1-yl]propyl]imidazolidine-2,4-dione (PubChem CID 167991701) has the molecular formula C16H25N5O3 and a molecular weight of 335.41 g/mol. Its IUPAC name is 3-[3-[3,5-dimethyl-4-(4-methylmorpholin-3-yl)pyrazol-1-yl]propyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name3-[3-[3,5-dimethyl-4-(4-methylmorpholin-3-yl)pyrazol-1-yl]propyl]imidazolidine-2,4-dione
PubChem CID167991701
Molecular FormulaC16H25N5O3
Molecular Weight335.41 g/mol
Exact Mass335.20
IUPAC Name3-[3-[3,5-dimethyl-4-(4-methylmorpholin-3-yl)pyrazol-1-yl]propyl]imidazolidine-2,4-dione
SMILESCc1nn(CCCN2C(=O)CNC2=O)c(C)c1C1COCCN1C
InChIInChI=1S/C16H25N5O3/c1-11-15(13-10-24-8-7-19(13)3)12(2)21(18-11)6-4-5-20-14(22)9-17-16(20)23/h13H,4-10H2,1-3H3,(H,17,23)
InChIKeyBOOSKGXJYNQCLF-UHFFFAOYSA-N
XLogP0.44
TPSA79.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 3-[3-[3,5-dimethyl-4-(4-methylmorpholin-3-yl)pyrazol-1-yl]propyl]imidazolidine-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 3-[3-[3,5-dimethyl-4-(4-methylmorpholin-3-yl)pyrazol-1-yl]propyl]imidazolidine-2,4-dione?
The IUPAC name of 3-[3-[3,5-dimethyl-4-(4-methylmorpholin-3-yl)pyrazol-1-yl]propyl]imidazolidine-2,4-dione (CID 167991701) is 3-[3-[3,5-dimethyl-4-(4-methylmorpholin-3-yl)pyrazol-1-yl]propyl]imidazolidine-2,4-dione.
What is the SMILES notation for 3-[3-[3,5-dimethyl-4-(4-methylmorpholin-3-yl)pyrazol-1-yl]propyl]imidazolidine-2,4-dione?
The canonical SMILES for 3-[3-[3,5-dimethyl-4-(4-methylmorpholin-3-yl)pyrazol-1-yl]propyl]imidazolidine-2,4-dione is Cc1nn(CCCN2C(=O)CNC2=O)c(C)c1C1COCCN1C.
What is the InChIKey of 3-[3-[3,5-dimethyl-4-(4-methylmorpholin-3-yl)pyrazol-1-yl]propyl]imidazolidine-2,4-dione?
The InChIKey is BOOSKGXJYNQCLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N5O3/c1-11-15(13-10-24-8-7-19(13)3)12(2)21(18-11)6-4-5-20-14(22)9-17-16(20)23/h13H,4-10H2,1-3H3,(H,17,23).
What are the key properties of 3-[3-[3,5-dimethyl-4-(4-methylmorpholin-3-yl)pyrazol-1-yl]propyl]imidazolidine-2,4-dione?
3-[3-[3,5-dimethyl-4-(4-methylmorpholin-3-yl)pyrazol-1-yl]propyl]imidazolidine-2,4-dione has a molecular weight of 335.41 g/mol, XLogP of 0.44, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-[3,5-dimethyl-4-(4-methylmorpholin-3-yl)pyrazol-1-yl]propyl]imidazolidine-2,4-dione is sourced from PubChem (CID 167991701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).