N-(2-amino-2-hydroxyiminoethyl)nonanamide

C11H23N3O2 — CID 77069137

IUPACN-(2-amino-2-hydroxyiminoethyl)nonanamide
SMILESCCCCCCCCC(=O)NCC(N)=NO
InChIInChI=1S/C11H23N3O2/c1-2-3-4-5-6-7-8-11(15)13-9-10(12)14-16/h16H,2-9H2,1H3,(H2,12,14)(H,13,15)
InChIKeyCUXUFPIPJNVHNS-UHFFFAOYSA-N
MW229.32 g/mol
LogP1.60
Rot. Bonds9

About N-(2-amino-2-hydroxyiminoethyl)nonanamide

N-(2-amino-2-hydroxyiminoethyl)nonanamide (PubChem CID 77069137) has the molecular formula C11H23N3O2 and a molecular weight of 229.32 g/mol. Its IUPAC name is N-(2-amino-2-hydroxyiminoethyl)nonanamide.

Molecular Properties

Compound NameN-(2-amino-2-hydroxyiminoethyl)nonanamide
PubChem CID77069137
Molecular FormulaC11H23N3O2
Molecular Weight229.32 g/mol
Exact Mass229.18
IUPAC NameN-(2-amino-2-hydroxyiminoethyl)nonanamide
SMILESCCCCCCCCC(=O)NCC(N)=NO
InChIInChI=1S/C11H23N3O2/c1-2-3-4-5-6-7-8-11(15)13-9-10(12)14-16/h16H,2-9H2,1H3,(H2,12,14)(H,13,15)
InChIKeyCUXUFPIPJNVHNS-UHFFFAOYSA-N
XLogP1.60
TPSA87.71 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 51.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_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-amino-2-hydroxyiminoethyl)nonanamide?
The IUPAC name of N-(2-amino-2-hydroxyiminoethyl)nonanamide (CID 77069137) is N-(2-amino-2-hydroxyiminoethyl)nonanamide.
What is the SMILES notation for N-(2-amino-2-hydroxyiminoethyl)nonanamide?
The canonical SMILES for N-(2-amino-2-hydroxyiminoethyl)nonanamide is CCCCCCCCC(=O)NCC(N)=NO.
What is the InChIKey of N-(2-amino-2-hydroxyiminoethyl)nonanamide?
The InChIKey is CUXUFPIPJNVHNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2/c1-2-3-4-5-6-7-8-11(15)13-9-10(12)14-16/h16H,2-9H2,1H3,(H2,12,14)(H,13,15).
What are the key properties of N-(2-amino-2-hydroxyiminoethyl)nonanamide?
N-(2-amino-2-hydroxyiminoethyl)nonanamide has a molecular weight of 229.32 g/mol, XLogP of 1.60, 9 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-hydroxyiminoethyl)nonanamide is sourced from PubChem (CID 77069137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).