[4-(methylcarbamoyl)phenoxy]carbonylazanide;yttrium(3+)

C9H9N2O3Y+2 — CID 20789579

IUPAC[4-(methylcarbamoyl)phenoxy]carbonylazanide;yttrium(3+)
SMILESCNC(=O)c1ccc(OC([NH-])=O)cc1.[Y+3]
InChIInChI=1S/C9H10N2O3.Y/c1-11-8(12)6-2-4-7(5-3-6)14-9(10)13;/h2-5H,1H3,(H3,10,11,12,13);/q;+3/p-1
InChIKeySSTJYSUZYSTPCC-UHFFFAOYSA-M
MW282.09 g/mol
LogP1.59
Rot. Bonds2

About [4-(methylcarbamoyl)phenoxy]carbonylazanide;yttrium(3+)

[4-(methylcarbamoyl)phenoxy]carbonylazanide;yttrium(3+) (PubChem CID 20789579) has the molecular formula C9H9N2O3Y+2 and a molecular weight of 282.09 g/mol. Its IUPAC name is [4-(methylcarbamoyl)phenoxy]carbonylazanide;yttrium(3+).

Molecular Properties

Compound Name[4-(methylcarbamoyl)phenoxy]carbonylazanide;yttrium(3+)
PubChem CID20789579
Molecular FormulaC9H9N2O3Y+2
Molecular Weight282.09 g/mol
Exact Mass281.97
IUPAC Name[4-(methylcarbamoyl)phenoxy]carbonylazanide;yttrium(3+)
SMILESCNC(=O)c1ccc(OC([NH-])=O)cc1.[Y+3]
InChIInChI=1S/C9H10N2O3.Y/c1-11-8(12)6-2-4-7(5-3-6)14-9(10)13;/h2-5H,1H3,(H3,10,11,12,13);/q;+3/p-1
InChIKeySSTJYSUZYSTPCC-UHFFFAOYSA-M
XLogP1.59
TPSA79.20 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.09
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(methylcarbamoyl)phenyl] carbamate
CID 20789580
4-(4-aminophenoxy)-N-methylbenzamide
CID 131636828
N-methyl-4-[2-(methylamino)ethoxy]benzamide
CID 19915722
[4-(methylcarbamoyl)phenoxy]boronic acid
CID 139843165
N-methyl-4-[4-(trifluoromethyl)phenoxy]benzamide
CID 146305988
1-N,4-N-dimethylbenzene-1,4-dicarboxamide;dimethyl benzene-1,4-dicarboxylate
CID 158994697
N-methyl-4-(4-pentan-3-ylphenoxy)benzamide
CID 142415379
4-(3-bromopropoxy)-N-methylbenzamide
CID 82110408
N-methylbenzamide
CID 11954
4-heptoxy-N-methylbenzamide
CID 3291691
N-methyl-4-phenylmethoxybenzamide
CID 2996745
[4-(4-hydroxybenzoyl)phenyl] N-methylcarbamate
CID 117058910

Frequently Asked Questions

What is the IUPAC name of [4-(methylcarbamoyl)phenoxy]carbonylazanide;yttrium(3+)?
The IUPAC name of [4-(methylcarbamoyl)phenoxy]carbonylazanide;yttrium(3+) (CID 20789579) is [4-(methylcarbamoyl)phenoxy]carbonylazanide;yttrium(3+).
What is the SMILES notation for [4-(methylcarbamoyl)phenoxy]carbonylazanide;yttrium(3+)?
The canonical SMILES for [4-(methylcarbamoyl)phenoxy]carbonylazanide;yttrium(3+) is CNC(=O)c1ccc(OC([NH-])=O)cc1.[Y+3].
What is the InChIKey of [4-(methylcarbamoyl)phenoxy]carbonylazanide;yttrium(3+)?
The InChIKey is SSTJYSUZYSTPCC-UHFFFAOYSA-M. The full InChI is InChI=1S/C9H10N2O3.Y/c1-11-8(12)6-2-4-7(5-3-6)14-9(10)13;/h2-5H,1H3,(H3,10,11,12,13);/q;+3/p-1.
What are the key properties of [4-(methylcarbamoyl)phenoxy]carbonylazanide;yttrium(3+)?
[4-(methylcarbamoyl)phenoxy]carbonylazanide;yttrium(3+) has a molecular weight of 282.09 g/mol, XLogP of 1.59, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(methylcarbamoyl)phenoxy]carbonylazanide;yttrium(3+) is sourced from PubChem (CID 20789579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).