2-hydroxy-2-piperidin-1-ylethanimidamide

C7H15N3O — CID 175228742

IUPAC2-hydroxy-2-piperidin-1-ylethanimidamide
SMILES[H]/N=C(\N)C(O)N1CCCCC1
InChIInChI=1S/C7H15N3O/c8-6(9)7(11)10-4-2-1-3-5-10/h7,11H,1-5H2,(H3,8,9)
InChIKeyQJPXGZKDVSXERF-UHFFFAOYSA-N
MW157.22 g/mol
LogP-0.27
Rot. Bonds2

About 2-hydroxy-2-piperidin-1-ylethanimidamide

2-hydroxy-2-piperidin-1-ylethanimidamide (PubChem CID 175228742) has the molecular formula C7H15N3O and a molecular weight of 157.22 g/mol. Its IUPAC name is 2-hydroxy-2-piperidin-1-ylethanimidamide.

Molecular Properties

Compound Name2-hydroxy-2-piperidin-1-ylethanimidamide
PubChem CID175228742
Molecular FormulaC7H15N3O
Molecular Weight157.22 g/mol
Exact Mass157.12
IUPAC Name2-hydroxy-2-piperidin-1-ylethanimidamide
SMILES[H]/N=C(\N)C(O)N1CCCCC1
InChIInChI=1S/C7H15N3O/c8-6(9)7(11)10-4-2-1-3-5-10/h7,11H,1-5H2,(H3,8,9)
InChIKeyQJPXGZKDVSXERF-UHFFFAOYSA-N
XLogP-0.27
TPSA73.34 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.22
LogP ≤ 5-0.27
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 2-hydroxy-2-piperidin-1-ylethanimidamide?
The IUPAC name of 2-hydroxy-2-piperidin-1-ylethanimidamide (CID 175228742) is 2-hydroxy-2-piperidin-1-ylethanimidamide.
What is the SMILES notation for 2-hydroxy-2-piperidin-1-ylethanimidamide?
The canonical SMILES for 2-hydroxy-2-piperidin-1-ylethanimidamide is [H]/N=C(\N)C(O)N1CCCCC1.
What is the InChIKey of 2-hydroxy-2-piperidin-1-ylethanimidamide?
The InChIKey is QJPXGZKDVSXERF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N3O/c8-6(9)7(11)10-4-2-1-3-5-10/h7,11H,1-5H2,(H3,8,9).
What are the key properties of 2-hydroxy-2-piperidin-1-ylethanimidamide?
2-hydroxy-2-piperidin-1-ylethanimidamide has a molecular weight of 157.22 g/mol, XLogP of -0.27, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-2-piperidin-1-ylethanimidamide is sourced from PubChem (CID 175228742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).