N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2-piperidin-1-ylacetamide

C15H21N3O2 — CID 135671630

IUPACN-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2-piperidin-1-ylacetamide
SMILESC/C(=N\NC(=O)CN1CCCCC1)c1ccccc1O
InChIInChI=1S/C15H21N3O2/c1-12(13-7-3-4-8-14(13)19)16-17-15(20)11-18-9-5-2-6-10-18/h3-4,7-8,19H,2,5-6,9-11H2,1H3,(H,17,20)/b16-12+
InChIKeyXOKNGWOUDCXUOE-FOWTUZBSSA-N
MW275.35 g/mol
LogP1.72
Rot. Bonds4

About N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2-piperidin-1-ylacetamide

N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2-piperidin-1-ylacetamide (PubChem CID 135671630) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2-piperidin-1-ylacetamide.

Molecular Properties

Compound NameN-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2-piperidin-1-ylacetamide
PubChem CID135671630
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC NameN-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2-piperidin-1-ylacetamide
SMILESC/C(=N\NC(=O)CN1CCCCC1)c1ccccc1O
InChIInChI=1S/C15H21N3O2/c1-12(13-7-3-4-8-14(13)19)16-17-15(20)11-18-9-5-2-6-10-18/h3-4,7-8,19H,2,5-6,9-11H2,1H3,(H,17,20)/b16-12+
InChIKeyXOKNGWOUDCXUOE-FOWTUZBSSA-N
XLogP1.72
TPSA64.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'imine_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-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2-piperidin-1-ylacetamide?
The IUPAC name of N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2-piperidin-1-ylacetamide (CID 135671630) is N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2-piperidin-1-ylacetamide.
What is the SMILES notation for N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2-piperidin-1-ylacetamide?
The canonical SMILES for N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2-piperidin-1-ylacetamide is C/C(=N\NC(=O)CN1CCCCC1)c1ccccc1O.
What is the InChIKey of N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2-piperidin-1-ylacetamide?
The InChIKey is XOKNGWOUDCXUOE-FOWTUZBSSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-12(13-7-3-4-8-14(13)19)16-17-15(20)11-18-9-5-2-6-10-18/h3-4,7-8,19H,2,5-6,9-11H2,1H3,(H,17,20)/b16-12+.
What are the key properties of N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2-piperidin-1-ylacetamide?
N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2-piperidin-1-ylacetamide has a molecular weight of 275.35 g/mol, XLogP of 1.72, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2-piperidin-1-ylacetamide is sourced from PubChem (CID 135671630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).