(2Z)-3-amino-2-hydrazinylidene-1-methylimidazolidin-4-one

C4H9N5O — CID 91290617

IUPAC(2Z)-3-amino-2-hydrazinylidene-1-methylimidazolidin-4-one
SMILESCN1CC(=O)N(N)/C1=N\N
InChIInChI=1S/C4H9N5O/c1-8-2-3(10)9(6)4(8)7-5/h2,5-6H2,1H3/b7-4-
InChIKeyXHQCMNKKWUOFHF-DAXSKMNVSA-N
MW143.15 g/mol
LogP-2.14
Rot. Bonds

About (2Z)-3-amino-2-hydrazinylidene-1-methylimidazolidin-4-one

(2Z)-3-amino-2-hydrazinylidene-1-methylimidazolidin-4-one (PubChem CID 91290617) has the molecular formula C4H9N5O and a molecular weight of 143.15 g/mol. Its IUPAC name is (2Z)-3-amino-2-hydrazinylidene-1-methylimidazolidin-4-one.

Molecular Properties

Compound Name(2Z)-3-amino-2-hydrazinylidene-1-methylimidazolidin-4-one
PubChem CID91290617
Molecular FormulaC4H9N5O
Molecular Weight143.15 g/mol
Exact Mass143.08
IUPAC Name(2Z)-3-amino-2-hydrazinylidene-1-methylimidazolidin-4-one
SMILESCN1CC(=O)N(N)/C1=N\N
InChIInChI=1S/C4H9N5O/c1-8-2-3(10)9(6)4(8)7-5/h2,5-6H2,1H3/b7-4-
InChIKeyXHQCMNKKWUOFHF-DAXSKMNVSA-N
XLogP-2.14
TPSA87.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.15
LogP ≤ 5-2.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(2E)-3-amino-2-hydrazinylidene-1-methylimidazolidin-4-one
CID 59934338
1,4,7-trimethyl-1,4,7-triazonane-2,5,8-trione
CID 71358039
N-(1,3-dimethyl-4-oxoimidazolidin-2-ylidene)acetamide
CID 130769760
(2E)-2-hydrazinylidene-1-methylimidazolidin-4-one
CID 136626142
N-(3-acetyl-1-methyl-4-oxoimidazolidin-2-ylidene)acetamide
CID 91716816
1,3,5-trimethyl-1,3,5-triazepane-2,4,6-trione
CID 139515723
3-(4-aminophenyl)-1-methylimidazolidine-2,4-dione
CID 58896389
1-[4-[(1-aminocyclopropyl)methyl]phenyl]-4-methylpiperazine-2,5-dione
CID 117436102
2,2,2-trifluoro-N-[1-methyl-4-oxo-3-(2,2,2-trifluoroacetyl)imidazolidin-2-ylidene]acetamide
CID 91737313
1-methyl-3-methylsulfanylimidazolidine-2,4-dione
CID 170140676
1-methyl-3-propan-2-ylimidazolidine-2,4-dione
CID 18669456
1,3-dimethyl-2-sulfanylideneimidazolidin-4-one;ethane
CID 142135855

Frequently Asked Questions

What is the IUPAC name of (2Z)-3-amino-2-hydrazinylidene-1-methylimidazolidin-4-one?
The IUPAC name of (2Z)-3-amino-2-hydrazinylidene-1-methylimidazolidin-4-one (CID 91290617) is (2Z)-3-amino-2-hydrazinylidene-1-methylimidazolidin-4-one.
What is the SMILES notation for (2Z)-3-amino-2-hydrazinylidene-1-methylimidazolidin-4-one?
The canonical SMILES for (2Z)-3-amino-2-hydrazinylidene-1-methylimidazolidin-4-one is CN1CC(=O)N(N)/C1=N\N.
What is the InChIKey of (2Z)-3-amino-2-hydrazinylidene-1-methylimidazolidin-4-one?
The InChIKey is XHQCMNKKWUOFHF-DAXSKMNVSA-N. The full InChI is InChI=1S/C4H9N5O/c1-8-2-3(10)9(6)4(8)7-5/h2,5-6H2,1H3/b7-4-.
What are the key properties of (2Z)-3-amino-2-hydrazinylidene-1-methylimidazolidin-4-one?
(2Z)-3-amino-2-hydrazinylidene-1-methylimidazolidin-4-one has a molecular weight of 143.15 g/mol, XLogP of -2.14, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-3-amino-2-hydrazinylidene-1-methylimidazolidin-4-one is sourced from PubChem (CID 91290617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).