azane;methane;phosphoric acid

CH16N3O4P — CID 174060347

IUPACazane;methane;phosphoric acid
SMILESC.N.N.N.O=P(O)(O)O
InChIInChI=1S/CH4.3H3N.H3O4P/c;;;;1-5(2,3)4/h1H4;3*1H3;(H3,1,2,3,4)
InChIKeyBDADXWYGNZPBJK-UHFFFAOYSA-N
MW165.13 g/mol
LogP0.19
Rot. Bonds

About azane;methane;phosphoric acid

azane;methane;phosphoric acid (PubChem CID 174060347) has the molecular formula CH16N3O4P and a molecular weight of 165.13 g/mol. Its IUPAC name is azane;methane;phosphoric acid.

Molecular Properties

Compound Nameazane;methane;phosphoric acid
PubChem CID174060347
Molecular FormulaCH16N3O4P
Molecular Weight165.13 g/mol
Exact Mass165.09
IUPAC Nameazane;methane;phosphoric acid
SMILESC.N.N.N.O=P(O)(O)O
InChIInChI=1S/CH4.3H3N.H3O4P/c;;;;1-5(2,3)4/h1H4;3*1H3;(H3,1,2,3,4)
InChIKeyBDADXWYGNZPBJK-UHFFFAOYSA-N
XLogP0.19
TPSA182.76 Ų
H-Bond Donors6
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500165.13
LogP ≤ 50.19
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

methane;phosphoric acid
CID 18515646
methane;phosphoric acid
CID 173400304
azane;phosphoric acid
CID 174789402
CID 172998917
CID 172998917
azane;phosphoric acid;hydrate
CID 173222009
azane;phosphoric acid;dihydrochloride
CID 173049818
azane;iron;phosphoric acid
CID 174725470
azane;phosphoric acid;tungsten
CID 174566468
cesium;azane;hydride;phosphoric acid
CID 174611777
dipotassium;hydride;methane;phosphoric acid
CID 173423611
magnesium;hydride;methane;phosphoric acid
CID 173272827
azane;hydroxylamine;phosphoric acid
CID 173277328

Frequently Asked Questions

What is the IUPAC name of azane;methane;phosphoric acid?
The IUPAC name of azane;methane;phosphoric acid (CID 174060347) is azane;methane;phosphoric acid.
What is the SMILES notation for azane;methane;phosphoric acid?
The canonical SMILES for azane;methane;phosphoric acid is C.N.N.N.O=P(O)(O)O.
What is the InChIKey of azane;methane;phosphoric acid?
The InChIKey is BDADXWYGNZPBJK-UHFFFAOYSA-N. The full InChI is InChI=1S/CH4.3H3N.H3O4P/c;;;;1-5(2,3)4/h1H4;3*1H3;(H3,1,2,3,4).
What are the key properties of azane;methane;phosphoric acid?
azane;methane;phosphoric acid has a molecular weight of 165.13 g/mol, XLogP of 0.19, 0 rotatable bonds, 6 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for azane;methane;phosphoric acid is sourced from PubChem (CID 174060347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).