N'-hydroxypiperidine-1-carboximidamide

C6H13N3O — CID 6028674

IUPACN'-hydroxypiperidine-1-carboximidamide
SMILESN/C(=N/O)N1CCCCC1
InChIInChI=1S/C6H13N3O/c7-6(8-10)9-4-2-1-3-5-9/h10H,1-5H2,(H2,7,8)
InChIKeyWDKQNCOJYGKYPL-UHFFFAOYSA-N
MW143.19 g/mol
LogP0.18
Rot. Bonds

About N'-hydroxypiperidine-1-carboximidamide

N'-hydroxypiperidine-1-carboximidamide (PubChem CID 6028674) has the molecular formula C6H13N3O and a molecular weight of 143.19 g/mol. Its IUPAC name is N'-hydroxypiperidine-1-carboximidamide.

Molecular Properties

Compound NameN'-hydroxypiperidine-1-carboximidamide
PubChem CID6028674
Molecular FormulaC6H13N3O
Molecular Weight143.19 g/mol
Exact Mass143.11
IUPAC NameN'-hydroxypiperidine-1-carboximidamide
SMILESN/C(=N/O)N1CCCCC1
InChIInChI=1S/C6H13N3O/c7-6(8-10)9-4-2-1-3-5-9/h10H,1-5H2,(H2,7,8)
InChIKeyWDKQNCOJYGKYPL-UHFFFAOYSA-N
XLogP0.18
TPSA61.85 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-hydroxypiperidine-1-carboximidamide?
The IUPAC name of N'-hydroxypiperidine-1-carboximidamide (CID 6028674) is N'-hydroxypiperidine-1-carboximidamide.
What is the SMILES notation for N'-hydroxypiperidine-1-carboximidamide?
The canonical SMILES for N'-hydroxypiperidine-1-carboximidamide is N/C(=N/O)N1CCCCC1.
What is the InChIKey of N'-hydroxypiperidine-1-carboximidamide?
The InChIKey is WDKQNCOJYGKYPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N3O/c7-6(8-10)9-4-2-1-3-5-9/h10H,1-5H2,(H2,7,8).
What are the key properties of N'-hydroxypiperidine-1-carboximidamide?
N'-hydroxypiperidine-1-carboximidamide has a molecular weight of 143.19 g/mol, XLogP of 0.18, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxypiperidine-1-carboximidamide is sourced from PubChem (CID 6028674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).