N-hydroxybicyclo[2.2.1]hept-5-ene-2-carboxamide

C8H11NO2 — CID 2999321

IUPACN-hydroxybicyclo[2.2.1]hept-5-ene-2-carboxamide
SMILESO=C(NO)C1CC2C=CC1C2
InChIInChI=1S/C8H11NO2/c10-8(9-11)7-4-5-1-2-6(7)3-5/h1-2,5-7,11H,3-4H2,(H,9,10)
InChIKeyIJKQNYVVENYLEA-UHFFFAOYSA-N
MW153.18 g/mol
LogP0.70
Rot. Bonds1

About N-hydroxybicyclo[2.2.1]hept-5-ene-2-carboxamide

N-hydroxybicyclo[2.2.1]hept-5-ene-2-carboxamide (PubChem CID 2999321) has the molecular formula C8H11NO2 and a molecular weight of 153.18 g/mol. Its IUPAC name is N-hydroxybicyclo[2.2.1]hept-5-ene-2-carboxamide.

Molecular Properties

Compound NameN-hydroxybicyclo[2.2.1]hept-5-ene-2-carboxamide
PubChem CID2999321
Molecular FormulaC8H11NO2
Molecular Weight153.18 g/mol
Exact Mass153.08
IUPAC NameN-hydroxybicyclo[2.2.1]hept-5-ene-2-carboxamide
SMILESO=C(NO)C1CC2C=CC1C2
InChIInChI=1S/C8H11NO2/c10-8(9-11)7-4-5-1-2-6(7)3-5/h1-2,5-7,11H,3-4H2,(H,9,10)
InChIKeyIJKQNYVVENYLEA-UHFFFAOYSA-N
XLogP0.70
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-hydroxybicyclo[2.2.1]hept-5-ene-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-hydroxybicyclo[2.2.1]hept-5-ene-2-carboxamide?
The IUPAC name of N-hydroxybicyclo[2.2.1]hept-5-ene-2-carboxamide (CID 2999321) is N-hydroxybicyclo[2.2.1]hept-5-ene-2-carboxamide.
What is the SMILES notation for N-hydroxybicyclo[2.2.1]hept-5-ene-2-carboxamide?
The canonical SMILES for N-hydroxybicyclo[2.2.1]hept-5-ene-2-carboxamide is O=C(NO)C1CC2C=CC1C2.
What is the InChIKey of N-hydroxybicyclo[2.2.1]hept-5-ene-2-carboxamide?
The InChIKey is IJKQNYVVENYLEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO2/c10-8(9-11)7-4-5-1-2-6(7)3-5/h1-2,5-7,11H,3-4H2,(H,9,10).
What are the key properties of N-hydroxybicyclo[2.2.1]hept-5-ene-2-carboxamide?
N-hydroxybicyclo[2.2.1]hept-5-ene-2-carboxamide has a molecular weight of 153.18 g/mol, XLogP of 0.70, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxybicyclo[2.2.1]hept-5-ene-2-carboxamide is sourced from PubChem (CID 2999321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).