4-amino-5-imino-1-methylimidazolidin-2-one

C4H8N4O — CID 163958322

IUPAC4-amino-5-imino-1-methylimidazolidin-2-one
SMILES[H]/N=C1/C(N)NC(=O)N1C
InChIInChI=1S/C4H8N4O/c1-8-3(6)2(5)7-4(8)9/h2,6H,5H2,1H3,(H,7,9)/b6-3-
InChIKeySFIHBXFFISCCMF-UTCJRWHESA-N
MW128.13 g/mol
LogP-1.10
Rot. Bonds

About 4-amino-5-imino-1-methylimidazolidin-2-one

4-amino-5-imino-1-methylimidazolidin-2-one (PubChem CID 163958322) has the molecular formula C4H8N4O and a molecular weight of 128.13 g/mol. Its IUPAC name is 4-amino-5-imino-1-methylimidazolidin-2-one.

Molecular Properties

Compound Name4-amino-5-imino-1-methylimidazolidin-2-one
PubChem CID163958322
Molecular FormulaC4H8N4O
Molecular Weight128.13 g/mol
Exact Mass128.07
IUPAC Name4-amino-5-imino-1-methylimidazolidin-2-one
SMILES[H]/N=C1/C(N)NC(=O)N1C
InChIInChI=1S/C4H8N4O/c1-8-3(6)2(5)7-4(8)9/h2,6H,5H2,1H3,(H,7,9)/b6-3-
InChIKeySFIHBXFFISCCMF-UTCJRWHESA-N
XLogP-1.10
TPSA82.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.13
LogP ≤ 5-1.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

4-amino-1-methyl-2,5-dihydro-1H-imidazol-2-one
CID 137701259
Iminodimethylimidazolidinon
CID 12571568
2-[(E)-(1,3-dimethyl-2-oxoimidazolidin-4-ylidene)amino]guanidine
CID 12066797
2-Oxoimidazolidine-1-carboximidamide
CID 19063872
1-(1,1-Diaminoethyl)-5-hydrazinylideneimidazolidin-2-one
CID 69115496
4-Hydrazinylidene-1,3-dimethylimidazolidin-2-one
CID 69115894
4-Ethyliminoimidazolidin-2-one
CID 140604957
Ethane;4-imino-1-methylimidazolidin-2-one
CID 142360748
(4Z)-N,3-dimethyl-4-(methylcarbamoylimino)-2-oxoimidazolidine-1-carboxamide
CID 10680797
5-Imino-1-methylimidazolidin-2-one
CID 55286536
1-(2-Amino-2-iminoethyl)-3-ethyl-1-methylurea
CID 64406816
3-(2-Amino-2-iminoethyl)-1,1-dimethylurea
CID 79153880

Frequently Asked Questions

What is the IUPAC name of 4-amino-5-imino-1-methylimidazolidin-2-one?
The IUPAC name of 4-amino-5-imino-1-methylimidazolidin-2-one (CID 163958322) is 4-amino-5-imino-1-methylimidazolidin-2-one.
What is the SMILES notation for 4-amino-5-imino-1-methylimidazolidin-2-one?
The canonical SMILES for 4-amino-5-imino-1-methylimidazolidin-2-one is [H]/N=C1/C(N)NC(=O)N1C.
What is the InChIKey of 4-amino-5-imino-1-methylimidazolidin-2-one?
The InChIKey is SFIHBXFFISCCMF-UTCJRWHESA-N. The full InChI is InChI=1S/C4H8N4O/c1-8-3(6)2(5)7-4(8)9/h2,6H,5H2,1H3,(H,7,9)/b6-3-.
What are the key properties of 4-amino-5-imino-1-methylimidazolidin-2-one?
4-amino-5-imino-1-methylimidazolidin-2-one has a molecular weight of 128.13 g/mol, XLogP of -1.10, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-imino-1-methylimidazolidin-2-one is sourced from PubChem (CID 163958322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).