nitroso 2-hydroxydecanoate

C10H19NO4 — CID 175298804

IUPACnitroso 2-hydroxydecanoate
SMILESCCCCCCCCC(O)C(=O)ON=O
InChIInChI=1S/C10H19NO4/c1-2-3-4-5-6-7-8-9(12)10(13)15-11-14/h9,12H,2-8H2,1H3
InChIKeyDZJLLNZIAJBOIR-UHFFFAOYSA-N
MW217.26 g/mol
LogP2.32
Rot. Bonds9

About nitroso 2-hydroxydecanoate

nitroso 2-hydroxydecanoate (PubChem CID 175298804) has the molecular formula C10H19NO4 and a molecular weight of 217.26 g/mol. Its IUPAC name is nitroso 2-hydroxydecanoate.

Molecular Properties

Compound Namenitroso 2-hydroxydecanoate
PubChem CID175298804
Molecular FormulaC10H19NO4
Molecular Weight217.26 g/mol
Exact Mass217.13
IUPAC Namenitroso 2-hydroxydecanoate
SMILESCCCCCCCCC(O)C(=O)ON=O
InChIInChI=1S/C10H19NO4/c1-2-3-4-5-6-7-8-9(12)10(13)15-11-14/h9,12H,2-8H2,1H3
InChIKeyDZJLLNZIAJBOIR-UHFFFAOYSA-N
XLogP2.32
TPSA75.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.26
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze nitroso 2-hydroxydecanoate 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

nitroso 2-octyltetradecanoate
CID 174324737
nitroso 2-methyldecanoate
CID 174579613
ethyl (2S)-2-hydroxytetracosanoate
CID 98049873
octacosyl 2-hydroxyoctadecanoate
CID 152554946
octadecyl 2-hydroxydocosanoate
CID 22753830
2-hydroxyoctadecanamide
CID 14598043
ethyl 2-hydroxyheptanoate
CID 12743783
methyl (2S)-2-hydroxyheptanoate
CID 71444954
2-(2-hydroxyoctanoyloxy)decanoic acid
CID 57111735
2-(2-hydroxyhexadecanoyloxy)hexadecanoic acid
CID 54201364
5-hydroxyoctacosyl 2-hydroxyoctadecanoate
CID 160811798
hexyl 2-hydroxyhexanoate;hydrochloride
CID 174906603

Frequently Asked Questions

What is the IUPAC name of nitroso 2-hydroxydecanoate?
The IUPAC name of nitroso 2-hydroxydecanoate (CID 175298804) is nitroso 2-hydroxydecanoate.
What is the SMILES notation for nitroso 2-hydroxydecanoate?
The canonical SMILES for nitroso 2-hydroxydecanoate is CCCCCCCCC(O)C(=O)ON=O.
What is the InChIKey of nitroso 2-hydroxydecanoate?
The InChIKey is DZJLLNZIAJBOIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO4/c1-2-3-4-5-6-7-8-9(12)10(13)15-11-14/h9,12H,2-8H2,1H3.
What are the key properties of nitroso 2-hydroxydecanoate?
nitroso 2-hydroxydecanoate has a molecular weight of 217.26 g/mol, XLogP of 2.32, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for nitroso 2-hydroxydecanoate is sourced from PubChem (CID 175298804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).