aminophosphonous acid;pteridine

C6H8N5O2P — CID 67674646

IUPACaminophosphonous acid;pteridine
SMILESNP(O)O.c1cnc2ncncc2n1
InChIInChI=1S/C6H4N4.H4NO2P/c1-2-9-6-5(8-1)3-7-4-10-6;1-4(2)3/h1-4H;2-3H,1H2
InChIKeyAXBCECMBYUJKLZ-UHFFFAOYSA-N
MW213.14 g/mol
LogP-0.42
Rot. Bonds

About aminophosphonous acid;pteridine

aminophosphonous acid;pteridine (PubChem CID 67674646) has the molecular formula C6H8N5O2P and a molecular weight of 213.14 g/mol. Its IUPAC name is aminophosphonous acid;pteridine.

Molecular Properties

Compound Nameaminophosphonous acid;pteridine
PubChem CID67674646
Molecular FormulaC6H8N5O2P
Molecular Weight213.14 g/mol
Exact Mass213.04
IUPAC Nameaminophosphonous acid;pteridine
SMILESNP(O)O.c1cnc2ncncc2n1
InChIInChI=1S/C6H4N4.H4NO2P/c1-2-9-6-5(8-1)3-7-4-10-6;1-4(2)3/h1-4H;2-3H,1H2
InChIKeyAXBCECMBYUJKLZ-UHFFFAOYSA-N
XLogP-0.42
TPSA118.04 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.14
LogP ≤ 5-0.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of aminophosphonous acid;pteridine?
The IUPAC name of aminophosphonous acid;pteridine (CID 67674646) is aminophosphonous acid;pteridine.
What is the SMILES notation for aminophosphonous acid;pteridine?
The canonical SMILES for aminophosphonous acid;pteridine is NP(O)O.c1cnc2ncncc2n1.
What is the InChIKey of aminophosphonous acid;pteridine?
The InChIKey is AXBCECMBYUJKLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4N4.H4NO2P/c1-2-9-6-5(8-1)3-7-4-10-6;1-4(2)3/h1-4H;2-3H,1H2.
What are the key properties of aminophosphonous acid;pteridine?
aminophosphonous acid;pteridine has a molecular weight of 213.14 g/mol, XLogP of -0.42, 0 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for aminophosphonous acid;pteridine is sourced from PubChem (CID 67674646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).