1-hydroxypiperidine-2-carboximidamide

C6H13N3O — CID 23000714

IUPAC1-hydroxypiperidine-2-carboximidamide
SMILES[H]/N=C(\N)C1CCCCN1O
InChIInChI=1S/C6H13N3O/c7-6(8)5-3-1-2-4-9(5)10/h5,10H,1-4H2,(H3,7,8)
InChIKeyRFHITBIUTKIKFK-UHFFFAOYSA-N
MW143.19 g/mol
LogP0.17
Rot. Bonds1

About 1-hydroxypiperidine-2-carboximidamide

1-hydroxypiperidine-2-carboximidamide (PubChem CID 23000714) has the molecular formula C6H13N3O and a molecular weight of 143.19 g/mol. Its IUPAC name is 1-hydroxypiperidine-2-carboximidamide.

Molecular Properties

Compound Name1-hydroxypiperidine-2-carboximidamide
PubChem CID23000714
Molecular FormulaC6H13N3O
Molecular Weight143.19 g/mol
Exact Mass143.11
IUPAC Name1-hydroxypiperidine-2-carboximidamide
SMILES[H]/N=C(\N)C1CCCCN1O
InChIInChI=1S/C6H13N3O/c7-6(8)5-3-1-2-4-9(5)10/h5,10H,1-4H2,(H3,7,8)
InChIKeyRFHITBIUTKIKFK-UHFFFAOYSA-N
XLogP0.17
TPSA73.34 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 50.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-hydroxypiperidine-2-carboximidamide?
The IUPAC name of 1-hydroxypiperidine-2-carboximidamide (CID 23000714) is 1-hydroxypiperidine-2-carboximidamide.
What is the SMILES notation for 1-hydroxypiperidine-2-carboximidamide?
The canonical SMILES for 1-hydroxypiperidine-2-carboximidamide is [H]/N=C(\N)C1CCCCN1O.
What is the InChIKey of 1-hydroxypiperidine-2-carboximidamide?
The InChIKey is RFHITBIUTKIKFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N3O/c7-6(8)5-3-1-2-4-9(5)10/h5,10H,1-4H2,(H3,7,8).
What are the key properties of 1-hydroxypiperidine-2-carboximidamide?
1-hydroxypiperidine-2-carboximidamide has a molecular weight of 143.19 g/mol, XLogP of 0.17, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxypiperidine-2-carboximidamide is sourced from PubChem (CID 23000714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).