N-(2-adamantylideneamino)-2-hydroxybenzamide

C17H20N2O2 — CID 910009

IUPACN-(2-adamantylideneamino)-2-hydroxybenzamide
SMILESO=C(NN=C1C2CC3CC(C2)CC1C3)c1ccccc1O
InChIInChI=1S/C17H20N2O2/c20-15-4-2-1-3-14(15)17(21)19-18-16-12-6-10-5-11(8-12)9-13(16)7-10/h1-4,10-13,20H,5-9H2,(H,19,21)/b18-16-
InChIKeyUHMSPQQBMSZIEC-VLGSPTGOSA-N
MW284.36 g/mol
LogP2.93
Rot. Bonds2

About N-(2-adamantylideneamino)-2-hydroxybenzamide

N-(2-adamantylideneamino)-2-hydroxybenzamide (PubChem CID 910009) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is N-(2-adamantylideneamino)-2-hydroxybenzamide.

Molecular Properties

Compound NameN-(2-adamantylideneamino)-2-hydroxybenzamide
PubChem CID910009
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC NameN-(2-adamantylideneamino)-2-hydroxybenzamide
SMILESO=C(NN=C1C2CC3CC(C2)CC1C3)c1ccccc1O
InChIInChI=1S/C17H20N2O2/c20-15-4-2-1-3-14(15)17(21)19-18-16-12-6-10-5-11(8-12)9-13(16)7-10/h1-4,10-13,20H,5-9H2,(H,19,21)/b18-16-
InChIKeyUHMSPQQBMSZIEC-VLGSPTGOSA-N
XLogP2.93
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'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-(2-adamantylideneamino)-2-hydroxybenzamide?
The IUPAC name of N-(2-adamantylideneamino)-2-hydroxybenzamide (CID 910009) is N-(2-adamantylideneamino)-2-hydroxybenzamide.
What is the SMILES notation for N-(2-adamantylideneamino)-2-hydroxybenzamide?
The canonical SMILES for N-(2-adamantylideneamino)-2-hydroxybenzamide is O=C(NN=C1C2CC3CC(C2)CC1C3)c1ccccc1O.
What is the InChIKey of N-(2-adamantylideneamino)-2-hydroxybenzamide?
The InChIKey is UHMSPQQBMSZIEC-VLGSPTGOSA-N. The full InChI is InChI=1S/C17H20N2O2/c20-15-4-2-1-3-14(15)17(21)19-18-16-12-6-10-5-11(8-12)9-13(16)7-10/h1-4,10-13,20H,5-9H2,(H,19,21)/b18-16-.
What are the key properties of N-(2-adamantylideneamino)-2-hydroxybenzamide?
N-(2-adamantylideneamino)-2-hydroxybenzamide has a molecular weight of 284.36 g/mol, XLogP of 2.93, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-adamantylideneamino)-2-hydroxybenzamide is sourced from PubChem (CID 910009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).