1-hydroxycyclopropane-1-carboximidamide

C4H8N2O — CID 55284668

IUPAC1-hydroxycyclopropane-1-carboximidamide
SMILES[H]/N=C(\N)C1(O)CC1
InChIInChI=1S/C4H8N2O/c5-3(6)4(7)1-2-4/h7H,1-2H2,(H3,5,6)
InChIKeyALBAMDSKFGSBMO-UHFFFAOYSA-N
MW100.12 g/mol
LogP-0.55
Rot. Bonds1

About 1-hydroxycyclopropane-1-carboximidamide

1-hydroxycyclopropane-1-carboximidamide (PubChem CID 55284668) has the molecular formula C4H8N2O and a molecular weight of 100.12 g/mol. Its IUPAC name is 1-hydroxycyclopropane-1-carboximidamide.

Molecular Properties

Compound Name1-hydroxycyclopropane-1-carboximidamide
PubChem CID55284668
Molecular FormulaC4H8N2O
Molecular Weight100.12 g/mol
Exact Mass100.06
IUPAC Name1-hydroxycyclopropane-1-carboximidamide
SMILES[H]/N=C(\N)C1(O)CC1
InChIInChI=1S/C4H8N2O/c5-3(6)4(7)1-2-4/h7H,1-2H2,(H3,5,6)
InChIKeyALBAMDSKFGSBMO-UHFFFAOYSA-N
XLogP-0.55
TPSA70.10 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.12
LogP ≤ 5-0.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

1-aminocyclopentane-1-carboximidamide
CID 75356225
bicyclo[2.2.2]octane-1-carboximidamide
CID 141169687
cyclopentane;ethanimidamide
CID 158057030
3,5,7-trimethyladamantane-1-carboximidamide;hydrochloride
CID 18373599
1-phenylcyclobutane-1-carboximidamide
CID 46941849
cobalt;ethanimidamide
CID 162055614
1-(sulfamoylamino)cycloheptane-1-carboximidamide
CID 114959695
ethanimidamide;guanidine
CID 160661984
ethanimidamide;hydrate;hydrochloride
CID 160733537
1-ethoxy-4-methylcyclohexane-1-carboximidamide
CID 116740221
4,4-difluorocyclohexane-1-carboximidamide
CID 83854458
4-methyl-1-(3-methylpyrazin-2-yl)piperidine-4-carboximidamide
CID 107162294

Frequently Asked Questions

What is the IUPAC name of 1-hydroxycyclopropane-1-carboximidamide?
The IUPAC name of 1-hydroxycyclopropane-1-carboximidamide (CID 55284668) is 1-hydroxycyclopropane-1-carboximidamide.
What is the SMILES notation for 1-hydroxycyclopropane-1-carboximidamide?
The canonical SMILES for 1-hydroxycyclopropane-1-carboximidamide is [H]/N=C(\N)C1(O)CC1.
What is the InChIKey of 1-hydroxycyclopropane-1-carboximidamide?
The InChIKey is ALBAMDSKFGSBMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N2O/c5-3(6)4(7)1-2-4/h7H,1-2H2,(H3,5,6).
What are the key properties of 1-hydroxycyclopropane-1-carboximidamide?
1-hydroxycyclopropane-1-carboximidamide has a molecular weight of 100.12 g/mol, XLogP of -0.55, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxycyclopropane-1-carboximidamide is sourced from PubChem (CID 55284668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).