pentadecoxyphosphonamidous acid

C15H34NO2P — CID 149252404

IUPACpentadecoxyphosphonamidous acid
SMILESCCCCCCCCCCCCCCCOP(N)O
InChIInChI=1S/C15H34NO2P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-19(16)17/h17H,2-16H2,1H3
InChIKeyGRJUCFFTMZOXBV-UHFFFAOYSA-N
MW291.42 g/mol
LogP5.27
Rot. Bonds15

About pentadecoxyphosphonamidous acid

pentadecoxyphosphonamidous acid (PubChem CID 149252404) has the molecular formula C15H34NO2P and a molecular weight of 291.42 g/mol. Its IUPAC name is pentadecoxyphosphonamidous acid.

Molecular Properties

Compound Namepentadecoxyphosphonamidous acid
PubChem CID149252404
Molecular FormulaC15H34NO2P
Molecular Weight291.42 g/mol
Exact Mass291.23
IUPAC Namepentadecoxyphosphonamidous acid
SMILESCCCCCCCCCCCCCCCOP(N)O
InChIInChI=1S/C15H34NO2P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-19(16)17/h17H,2-16H2,1H3
InChIKeyGRJUCFFTMZOXBV-UHFFFAOYSA-N
XLogP5.27
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds15
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500291.42
LogP ≤ 55.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

didecyl hydrogen phosphite
CID 14151265
azane;hexyl dihydrogen phosphite
CID 173357133
propyl tetradecyl hydrogen phosphite
CID 121403997
pentyl dihydrogen phosphite;zinc
CID 88839337
hexyl methyl hydrogen phosphite
CID 22731198
triheptadecyl phosphite
CID 23435031
4-hydroxybutyl tridecyl hydrogen phosphite
CID 154235409
dihydroxy(oxo)titanium;bis(ditridecyl hydrogen phosphite)
CID 87482236
diethyl(hexoxy)phosphane
CID 87283104
disodium;hexyl phosphite
CID 139691830
chloro(didodecoxy)phosphane
CID 54405346
decoxy(octoxy)phosphinothious acid
CID 54152589

Frequently Asked Questions

What is the IUPAC name of pentadecoxyphosphonamidous acid?
The IUPAC name of pentadecoxyphosphonamidous acid (CID 149252404) is pentadecoxyphosphonamidous acid.
What is the SMILES notation for pentadecoxyphosphonamidous acid?
The canonical SMILES for pentadecoxyphosphonamidous acid is CCCCCCCCCCCCCCCOP(N)O.
What is the InChIKey of pentadecoxyphosphonamidous acid?
The InChIKey is GRJUCFFTMZOXBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H34NO2P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-19(16)17/h17H,2-16H2,1H3.
What are the key properties of pentadecoxyphosphonamidous acid?
pentadecoxyphosphonamidous acid has a molecular weight of 291.42 g/mol, XLogP of 5.27, 15 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for pentadecoxyphosphonamidous acid is sourced from PubChem (CID 149252404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).