5-ethyl-5-methyl-1-[(1-pentan-3-ylpyrazol-3-yl)methyl]imidazolidine-2,4-dione

C15H24N4O2 — CID 64778325

IUPAC5-ethyl-5-methyl-1-[(1-pentan-3-ylpyrazol-3-yl)methyl]imidazolidine-2,4-dione
SMILESCCC(CC)n1ccc(CN2C(=O)NC(=O)C2(C)CC)n1
InChIInChI=1S/C15H24N4O2/c1-5-12(6-2)19-9-8-11(17-19)10-18-14(21)16-13(20)15(18,4)7-3/h8-9,12H,5-7,10H2,1-4H3,(H,16,20,21)
InChIKeyFDLLNRWHZLDYQX-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.46
Rot. Bonds6

About 5-ethyl-5-methyl-1-[(1-pentan-3-ylpyrazol-3-yl)methyl]imidazolidine-2,4-dione

5-ethyl-5-methyl-1-[(1-pentan-3-ylpyrazol-3-yl)methyl]imidazolidine-2,4-dione (PubChem CID 64778325) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 5-ethyl-5-methyl-1-[(1-pentan-3-ylpyrazol-3-yl)methyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-ethyl-5-methyl-1-[(1-pentan-3-ylpyrazol-3-yl)methyl]imidazolidine-2,4-dione
PubChem CID64778325
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name5-ethyl-5-methyl-1-[(1-pentan-3-ylpyrazol-3-yl)methyl]imidazolidine-2,4-dione
SMILESCCC(CC)n1ccc(CN2C(=O)NC(=O)C2(C)CC)n1
InChIInChI=1S/C15H24N4O2/c1-5-12(6-2)19-9-8-11(17-19)10-18-14(21)16-13(20)15(18,4)7-3/h8-9,12H,5-7,10H2,1-4H3,(H,16,20,21)
InChIKeyFDLLNRWHZLDYQX-UHFFFAOYSA-N
XLogP2.46
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

5,5-diethyl-1-[(1-propan-2-ylpyrazol-3-yl)methyl]imidazolidine-2,4-dione
CID 64801529
1-[(1-pentan-3-ylpyrazol-3-yl)methyl]pyrimidin-2-one
CID 116618391
6-ethyl-6-methyl-1-[(1-methylpyrazol-3-yl)methyl]piperazine-2,5-dione
CID 82871112
6-ethyl-3,3,6-trimethyl-1-[(1-methylpyrazol-3-yl)methyl]piperazine-2,5-dione
CID 82871729
1-pentan-3-yl-3-(pyrrol-1-ylmethyl)pyrazole
CID 64779775
3-iodo-1-[(1-pentan-3-ylpyrazol-3-yl)methyl]pyridin-2-one
CID 79784713
3-methyl-1-[(1-pentan-3-ylpyrazol-3-yl)methyl]piperazin-2-one
CID 64777692
3-[(3-methylazetidin-3-yl)methyl]-1-pentan-3-ylpyrazole
CID 79451419
1-[(1-pentan-3-ylpyrazol-3-yl)methyl]-3-propan-2-ylimidazol-2-one
CID 116625039
3-(bromomethyl)-1-pentan-3-ylpyrazole
CID 81222884
3-methyl-3-[(1-pentan-3-ylpyrazol-3-yl)methyl]cyclopentan-1-one
CID 116538402
3,5-dimethyl-1-[(1-pentan-3-ylpyrazol-3-yl)methyl]pyrazole-4-carbaldehyde
CID 64785210

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-5-methyl-1-[(1-pentan-3-ylpyrazol-3-yl)methyl]imidazolidine-2,4-dione?
The IUPAC name of 5-ethyl-5-methyl-1-[(1-pentan-3-ylpyrazol-3-yl)methyl]imidazolidine-2,4-dione (CID 64778325) is 5-ethyl-5-methyl-1-[(1-pentan-3-ylpyrazol-3-yl)methyl]imidazolidine-2,4-dione.
What is the SMILES notation for 5-ethyl-5-methyl-1-[(1-pentan-3-ylpyrazol-3-yl)methyl]imidazolidine-2,4-dione?
The canonical SMILES for 5-ethyl-5-methyl-1-[(1-pentan-3-ylpyrazol-3-yl)methyl]imidazolidine-2,4-dione is CCC(CC)n1ccc(CN2C(=O)NC(=O)C2(C)CC)n1.
What is the InChIKey of 5-ethyl-5-methyl-1-[(1-pentan-3-ylpyrazol-3-yl)methyl]imidazolidine-2,4-dione?
The InChIKey is FDLLNRWHZLDYQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-5-12(6-2)19-9-8-11(17-19)10-18-14(21)16-13(20)15(18,4)7-3/h8-9,12H,5-7,10H2,1-4H3,(H,16,20,21).
What are the key properties of 5-ethyl-5-methyl-1-[(1-pentan-3-ylpyrazol-3-yl)methyl]imidazolidine-2,4-dione?
5-ethyl-5-methyl-1-[(1-pentan-3-ylpyrazol-3-yl)methyl]imidazolidine-2,4-dione has a molecular weight of 292.38 g/mol, XLogP of 2.46, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-5-methyl-1-[(1-pentan-3-ylpyrazol-3-yl)methyl]imidazolidine-2,4-dione is sourced from PubChem (CID 64778325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).