(2-amino-2-hydroxyiminoethyl)-nonylphosphinic acid

C11H25N2O3P — CID 167433591

IUPAC(2-amino-2-hydroxyiminoethyl)-nonylphosphinic acid
SMILESCCCCCCCCCP(=O)(O)CC(N)=NO
InChIInChI=1S/C11H25N2O3P/c1-2-3-4-5-6-7-8-9-17(15,16)10-11(12)13-14/h14H,2-10H2,1H3,(H2,12,13)(H,15,16)
InChIKeyNZAKGQJBLZPMDN-UHFFFAOYSA-N
MW264.31 g/mol
LogP2.75
Rot. Bonds10

About (2-amino-2-hydroxyiminoethyl)-nonylphosphinic acid

(2-amino-2-hydroxyiminoethyl)-nonylphosphinic acid (PubChem CID 167433591) has the molecular formula C11H25N2O3P and a molecular weight of 264.31 g/mol. Its IUPAC name is (2-amino-2-hydroxyiminoethyl)-nonylphosphinic acid.

Molecular Properties

Compound Name(2-amino-2-hydroxyiminoethyl)-nonylphosphinic acid
PubChem CID167433591
Molecular FormulaC11H25N2O3P
Molecular Weight264.31 g/mol
Exact Mass264.16
IUPAC Name(2-amino-2-hydroxyiminoethyl)-nonylphosphinic acid
SMILESCCCCCCCCCP(=O)(O)CC(N)=NO
InChIInChI=1S/C11H25N2O3P/c1-2-3-4-5-6-7-8-9-17(15,16)10-11(12)13-14/h14H,2-10H2,1H3,(H2,12,13)(H,15,16)
InChIKeyNZAKGQJBLZPMDN-UHFFFAOYSA-N
XLogP2.75
TPSA95.91 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.31
LogP ≤ 52.75
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'}

Analyze (2-amino-2-hydroxyiminoethyl)-nonylphosphinic acid with MolForge

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

Launch Full Analysis

Related Compounds

(2-amino-2-hydroxyiminoethyl)-hexoxyphosphinic acid
CID 167433583
didodecylphosphinic acid;nickel
CID 87135872
didecylphosphinic acid;nickel
CID 87135973
dioctadecylphosphinic acid;nickel
CID 87136046
2-[dodecyl(hydroxy)phosphoryl]acetic acid
CID 56691297
dihexylphosphinic acid;hexyl(propyl)phosphinic acid
CID 122574606
dodecyl-(2-ethoxy-2-oxoethyl)phosphinic acid
CID 44606055
hexylphosphonic acid;octylphosphonic acid
CID 155346901
1-didodecylphosphoryldodecane
CID 12543829
1-dihexylphosphorylhexane;1-dioctylphosphoryloctane
CID 121237547
2-[hexacosyl(2-hydroxyethyl)phosphoryl]ethanol
CID 172735074
dodecane;phosphoric acid
CID 88801558

Frequently Asked Questions

What is the IUPAC name of (2-amino-2-hydroxyiminoethyl)-nonylphosphinic acid?
The IUPAC name of (2-amino-2-hydroxyiminoethyl)-nonylphosphinic acid (CID 167433591) is (2-amino-2-hydroxyiminoethyl)-nonylphosphinic acid.
What is the SMILES notation for (2-amino-2-hydroxyiminoethyl)-nonylphosphinic acid?
The canonical SMILES for (2-amino-2-hydroxyiminoethyl)-nonylphosphinic acid is CCCCCCCCCP(=O)(O)CC(N)=NO.
What is the InChIKey of (2-amino-2-hydroxyiminoethyl)-nonylphosphinic acid?
The InChIKey is NZAKGQJBLZPMDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N2O3P/c1-2-3-4-5-6-7-8-9-17(15,16)10-11(12)13-14/h14H,2-10H2,1H3,(H2,12,13)(H,15,16).
What are the key properties of (2-amino-2-hydroxyiminoethyl)-nonylphosphinic acid?
(2-amino-2-hydroxyiminoethyl)-nonylphosphinic acid has a molecular weight of 264.31 g/mol, XLogP of 2.75, 10 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-2-hydroxyiminoethyl)-nonylphosphinic acid is sourced from PubChem (CID 167433591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).