4-methoxypiperidine-1-carboximidamide

C7H15N3O — CID 19089259

IUPAC4-methoxypiperidine-1-carboximidamide
SMILES[H]/N=C(\N)N1CCC(OC)CC1
InChIInChI=1S/C7H15N3O/c1-11-6-2-4-10(5-3-6)7(8)9/h6H,2-5H2,1H3,(H3,8,9)
InChIKeyOUKAZIMLLPOLKQ-UHFFFAOYSA-N
MW157.22 g/mol
LogP-0.01
Rot. Bonds1

About 4-methoxypiperidine-1-carboximidamide

4-methoxypiperidine-1-carboximidamide (PubChem CID 19089259) has the molecular formula C7H15N3O and a molecular weight of 157.22 g/mol. Its IUPAC name is 4-methoxypiperidine-1-carboximidamide.

Molecular Properties

Compound Name4-methoxypiperidine-1-carboximidamide
PubChem CID19089259
Molecular FormulaC7H15N3O
Molecular Weight157.22 g/mol
Exact Mass157.12
IUPAC Name4-methoxypiperidine-1-carboximidamide
SMILES[H]/N=C(\N)N1CCC(OC)CC1
InChIInChI=1S/C7H15N3O/c1-11-6-2-4-10(5-3-6)7(8)9/h6H,2-5H2,1H3,(H3,8,9)
InChIKeyOUKAZIMLLPOLKQ-UHFFFAOYSA-N
XLogP-0.01
TPSA62.34 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.22
LogP ≤ 5-0.01
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'}

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Frequently Asked Questions

What is the IUPAC name of 4-methoxypiperidine-1-carboximidamide?
The IUPAC name of 4-methoxypiperidine-1-carboximidamide (CID 19089259) is 4-methoxypiperidine-1-carboximidamide.
What is the SMILES notation for 4-methoxypiperidine-1-carboximidamide?
The canonical SMILES for 4-methoxypiperidine-1-carboximidamide is [H]/N=C(\N)N1CCC(OC)CC1.
What is the InChIKey of 4-methoxypiperidine-1-carboximidamide?
The InChIKey is OUKAZIMLLPOLKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N3O/c1-11-6-2-4-10(5-3-6)7(8)9/h6H,2-5H2,1H3,(H3,8,9).
What are the key properties of 4-methoxypiperidine-1-carboximidamide?
4-methoxypiperidine-1-carboximidamide has a molecular weight of 157.22 g/mol, XLogP of -0.01, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxypiperidine-1-carboximidamide is sourced from PubChem (CID 19089259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).