3-[(5-hydrazinylpyrazin-2-yl)methyl]-5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione

C10H11F3N6O2 — CID 103061507

IUPAC3-[(5-hydrazinylpyrazin-2-yl)methyl]-5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione
SMILESCC1(C(F)(F)F)NC(=O)N(Cc2cnc(NN)cn2)C1=O
InChIInChI=1S/C10H11F3N6O2/c1-9(10(11,12)13)7(20)19(8(21)17-9)4-5-2-16-6(18-14)3-15-5/h2-3H,4,14H2,1H3,(H,16,18)(H,17,21)
InChIKeyHRSPZGBGZWJXDS-UHFFFAOYSA-N
MW304.23 g/mol
LogP0.14
Rot. Bonds3

About 3-[(5-hydrazinylpyrazin-2-yl)methyl]-5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione

3-[(5-hydrazinylpyrazin-2-yl)methyl]-5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione (PubChem CID 103061507) has the molecular formula C10H11F3N6O2 and a molecular weight of 304.23 g/mol. Its IUPAC name is 3-[(5-hydrazinylpyrazin-2-yl)methyl]-5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name3-[(5-hydrazinylpyrazin-2-yl)methyl]-5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione
PubChem CID103061507
Molecular FormulaC10H11F3N6O2
Molecular Weight304.23 g/mol
Exact Mass304.09
IUPAC Name3-[(5-hydrazinylpyrazin-2-yl)methyl]-5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione
SMILESCC1(C(F)(F)F)NC(=O)N(Cc2cnc(NN)cn2)C1=O
InChIInChI=1S/C10H11F3N6O2/c1-9(10(11,12)13)7(20)19(8(21)17-9)4-5-2-16-6(18-14)3-15-5/h2-3H,4,14H2,1H3,(H,16,18)(H,17,21)
InChIKeyHRSPZGBGZWJXDS-UHFFFAOYSA-N
XLogP0.14
TPSA113.24 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.23
LogP ≤ 50.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-[(5-hydrazinylpyrazin-2-yl)methyl]imidazolidine-2,4-dione
CID 103061297
5-ethyl-3-[[5-(ethylamino)pyrazin-2-yl]methyl]-5-methylimidazolidine-2,4-dione
CID 103057107
2,2-dimethyl-3-[4-methyl-2,5-dioxo-4-(trifluoromethyl)imidazolidin-1-yl]propanehydrazide
CID 79630523
[5-[(4,4-dimethylpiperidin-1-yl)methyl]pyrazin-2-yl]hydrazine
CID 103060922
3-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]methyl]-5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione
CID 80611560
1-[(5-hydrazinylpyrazin-2-yl)methyl]-4-methylpiperazine-2,3-dione
CID 103061454
4-[(5-hydrazinylpyrazin-2-yl)methyl]piperazin-2-one
CID 103060800
3-(3-bromo-2,2-dimethylpropyl)-5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione
CID 64995013
1-[(5-hydrazinylpyrazin-2-yl)methyl]-4-methylpiperidin-4-ol
CID 103061144
[5-[(3-tert-butylpyrrolidin-1-yl)methyl]pyrazin-2-yl]hydrazine
CID 103061199
3-(2,3-dihydroxypropyl)-5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione
CID 82849872
[5-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]pyrazin-2-yl]hydrazine
CID 103061242

Frequently Asked Questions

What is the IUPAC name of 3-[(5-hydrazinylpyrazin-2-yl)methyl]-5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione?
The IUPAC name of 3-[(5-hydrazinylpyrazin-2-yl)methyl]-5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione (CID 103061507) is 3-[(5-hydrazinylpyrazin-2-yl)methyl]-5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione.
What is the SMILES notation for 3-[(5-hydrazinylpyrazin-2-yl)methyl]-5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione?
The canonical SMILES for 3-[(5-hydrazinylpyrazin-2-yl)methyl]-5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione is CC1(C(F)(F)F)NC(=O)N(Cc2cnc(NN)cn2)C1=O.
What is the InChIKey of 3-[(5-hydrazinylpyrazin-2-yl)methyl]-5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione?
The InChIKey is HRSPZGBGZWJXDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F3N6O2/c1-9(10(11,12)13)7(20)19(8(21)17-9)4-5-2-16-6(18-14)3-15-5/h2-3H,4,14H2,1H3,(H,16,18)(H,17,21).
What are the key properties of 3-[(5-hydrazinylpyrazin-2-yl)methyl]-5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione?
3-[(5-hydrazinylpyrazin-2-yl)methyl]-5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione has a molecular weight of 304.23 g/mol, XLogP of 0.14, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(5-hydrazinylpyrazin-2-yl)methyl]-5-methyl-5-(trifluoromethyl)imidazolidine-2,4-dione is sourced from PubChem (CID 103061507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).