N-(2-hydroxybenzene-5-id-1-yl)formamide;yttrium(3+)

C7H6NO2Y+2 — CID 54715983

IUPACN-(2-hydroxybenzene-5-id-1-yl)formamide;yttrium(3+)
SMILESO=CNc1c[c-]ccc1O.[Y+3]
InChIInChI=1S/C7H6NO2.Y/c9-5-8-6-3-1-2-4-7(6)10;/h2-5,10H,(H,8,9);/q-1;+3
InChIKeyLJIKYAMJPTYSOG-UHFFFAOYSA-N
MW225.04 g/mol
LogP0.76
Rot. Bonds2

About N-(2-hydroxybenzene-5-id-1-yl)formamide;yttrium(3+)

N-(2-hydroxybenzene-5-id-1-yl)formamide;yttrium(3+) (PubChem CID 54715983) has the molecular formula C7H6NO2Y+2 and a molecular weight of 225.04 g/mol. Its IUPAC name is N-(2-hydroxybenzene-5-id-1-yl)formamide;yttrium(3+).

Molecular Properties

Compound NameN-(2-hydroxybenzene-5-id-1-yl)formamide;yttrium(3+)
PubChem CID54715983
Molecular FormulaC7H6NO2Y+2
Molecular Weight225.04 g/mol
Exact Mass224.94
IUPAC NameN-(2-hydroxybenzene-5-id-1-yl)formamide;yttrium(3+)
SMILESO=CNc1c[c-]ccc1O.[Y+3]
InChIInChI=1S/C7H6NO2.Y/c9-5-8-6-3-1-2-4-7(6)10;/h2-5,10H,(H,8,9);/q-1;+3
InChIKeyLJIKYAMJPTYSOG-UHFFFAOYSA-N
XLogP0.76
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.04
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

N-(2-hydroxybenzene-5-id-1-yl)formamide;yttrium
CID 59911741
N-[(3E,5E)-6-hydroxyocta-1,3,5,7-tetraen-3-yl]formamide
CID 167132961

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxybenzene-5-id-1-yl)formamide;yttrium(3+)?
The IUPAC name of N-(2-hydroxybenzene-5-id-1-yl)formamide;yttrium(3+) (CID 54715983) is N-(2-hydroxybenzene-5-id-1-yl)formamide;yttrium(3+).
What is the SMILES notation for N-(2-hydroxybenzene-5-id-1-yl)formamide;yttrium(3+)?
The canonical SMILES for N-(2-hydroxybenzene-5-id-1-yl)formamide;yttrium(3+) is O=CNc1c[c-]ccc1O.[Y+3].
What is the InChIKey of N-(2-hydroxybenzene-5-id-1-yl)formamide;yttrium(3+)?
The InChIKey is LJIKYAMJPTYSOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6NO2.Y/c9-5-8-6-3-1-2-4-7(6)10;/h2-5,10H,(H,8,9);/q-1;+3.
What are the key properties of N-(2-hydroxybenzene-5-id-1-yl)formamide;yttrium(3+)?
N-(2-hydroxybenzene-5-id-1-yl)formamide;yttrium(3+) has a molecular weight of 225.04 g/mol, XLogP of 0.76, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxybenzene-5-id-1-yl)formamide;yttrium(3+) is sourced from PubChem (CID 54715983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).