2-aminoguanidine;2-imino-1-methylimidazolidin-4-one

C5H13N7O — CID 173326507

IUPAC2-aminoguanidine;2-imino-1-methylimidazolidin-4-one
SMILESNN=C(N)N.[H]/N=C1/NC(=O)CN1C
InChIInChI=1S/C4H7N3O.CH6N4/c1-7-2-3(8)6-4(7)5;2-1(3)5-4/h2H2,1H3,(H2,5,6,8);4H2,(H4,2,3,5)
InChIKeyMPWGJLGWAZSKSS-UHFFFAOYSA-N
MW187.21 g/mol
LogP-2.88
Rot. Bonds

About 2-aminoguanidine;2-imino-1-methylimidazolidin-4-one

2-aminoguanidine;2-imino-1-methylimidazolidin-4-one (PubChem CID 173326507) has the molecular formula C5H13N7O and a molecular weight of 187.21 g/mol. Its IUPAC name is 2-aminoguanidine;2-imino-1-methylimidazolidin-4-one.

Molecular Properties

Compound Name2-aminoguanidine;2-imino-1-methylimidazolidin-4-one
PubChem CID173326507
Molecular FormulaC5H13N7O
Molecular Weight187.21 g/mol
Exact Mass187.12
IUPAC Name2-aminoguanidine;2-imino-1-methylimidazolidin-4-one
SMILESNN=C(N)N.[H]/N=C1/NC(=O)CN1C
InChIInChI=1S/C4H7N3O.CH6N4/c1-7-2-3(8)6-4(7)5;2-1(3)5-4/h2H2,1H3,(H2,5,6,8);4H2,(H4,2,3,5)
InChIKeyMPWGJLGWAZSKSS-UHFFFAOYSA-N
XLogP-2.88
TPSA146.61 Ų
H-Bond Donors5
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.21
LogP ≤ 5-2.88
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-Imino-1-methyl-4-imidazolidinone
CID 137319715
2-Amino-1-(~13~C)methyl-1,5-dihydro-4H-imidazol-4-one
CID 153274188
Creatinine ZINC chloride
CID 137321690
zinc(2+) 2-amino-1-methyl-4,5-dihydro-1H-imidazol-4-one dichloride
CID 139267838
2-amino-1-methyl-4,5-dihydro-1H-imidazol-4-one hydrochloride
CID 137321695
2-Imino-1,3-dimethylimidazolidin-4-one
CID 14060427
3-Deuterio-2-deuterioimino-1-(deuteriomethyl)imidazolidin-4-one
CID 89612900
2-Chloroimino-1-methylimidazolidin-4-one
CID 136683013
2-Amino-1-ethyl-1,5-dihydro-4H-imidazol-4-one
CID 137321843
3-Deuterio-1-(1-deuterioethyl)-2-deuterioiminoimidazolidin-4-one
CID 91570612
2,5-Diamino-1-methyl-1H-imidazol-4(5H)-one
CID 154731276
Hydron;2-imino-1-methylimidazolidin-4-one;tetrachlorogold(1-)
CID 137321857

Frequently Asked Questions

What is the IUPAC name of 2-aminoguanidine;2-imino-1-methylimidazolidin-4-one?
The IUPAC name of 2-aminoguanidine;2-imino-1-methylimidazolidin-4-one (CID 173326507) is 2-aminoguanidine;2-imino-1-methylimidazolidin-4-one.
What is the SMILES notation for 2-aminoguanidine;2-imino-1-methylimidazolidin-4-one?
The canonical SMILES for 2-aminoguanidine;2-imino-1-methylimidazolidin-4-one is NN=C(N)N.[H]/N=C1/NC(=O)CN1C.
What is the InChIKey of 2-aminoguanidine;2-imino-1-methylimidazolidin-4-one?
The InChIKey is MPWGJLGWAZSKSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7N3O.CH6N4/c1-7-2-3(8)6-4(7)5;2-1(3)5-4/h2H2,1H3,(H2,5,6,8);4H2,(H4,2,3,5).
What are the key properties of 2-aminoguanidine;2-imino-1-methylimidazolidin-4-one?
2-aminoguanidine;2-imino-1-methylimidazolidin-4-one has a molecular weight of 187.21 g/mol, XLogP of -2.88, 0 rotatable bonds, 5 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoguanidine;2-imino-1-methylimidazolidin-4-one is sourced from PubChem (CID 173326507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).