N-methylpyrrolo[2,3-b]pyridin-1-ide-3-carboxamide;yttrium

C9H8N3OY- — CID 58011342

IUPACN-methylpyrrolo[2,3-b]pyridin-1-ide-3-carboxamide;yttrium
SMILESCNC(=O)c1c[n-]c2ncccc12.[Y]
InChIInChI=1S/C9H9N3O.Y/c1-10-9(13)7-5-12-8-6(7)3-2-4-11-8;/h2-5H,1H3,(H2,10,11,12,13);/p-1
InChIKeyYEYPWKCXHZBCFA-UHFFFAOYSA-M
MW263.09 g/mol
LogP0.55
Rot. Bonds1

About N-methylpyrrolo[2,3-b]pyridin-1-ide-3-carboxamide;yttrium

N-methylpyrrolo[2,3-b]pyridin-1-ide-3-carboxamide;yttrium (PubChem CID 58011342) has the molecular formula C9H8N3OY- and a molecular weight of 263.09 g/mol. Its IUPAC name is N-methylpyrrolo[2,3-b]pyridin-1-ide-3-carboxamide;yttrium.

Molecular Properties

Compound NameN-methylpyrrolo[2,3-b]pyridin-1-ide-3-carboxamide;yttrium
PubChem CID58011342
Molecular FormulaC9H8N3OY-
Molecular Weight263.09 g/mol
Exact Mass262.97
IUPAC NameN-methylpyrrolo[2,3-b]pyridin-1-ide-3-carboxamide;yttrium
SMILESCNC(=O)c1c[n-]c2ncccc12.[Y]
InChIInChI=1S/C9H9N3O.Y/c1-10-9(13)7-5-12-8-6(7)3-2-4-11-8;/h2-5H,1H3,(H2,10,11,12,13);/p-1
InChIKeyYEYPWKCXHZBCFA-UHFFFAOYSA-M
XLogP0.55
TPSA56.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.09
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methylpyrrolo[2,3-b]pyridin-1-ide-3-carboxamide;yttrium?
The IUPAC name of N-methylpyrrolo[2,3-b]pyridin-1-ide-3-carboxamide;yttrium (CID 58011342) is N-methylpyrrolo[2,3-b]pyridin-1-ide-3-carboxamide;yttrium.
What is the SMILES notation for N-methylpyrrolo[2,3-b]pyridin-1-ide-3-carboxamide;yttrium?
The canonical SMILES for N-methylpyrrolo[2,3-b]pyridin-1-ide-3-carboxamide;yttrium is CNC(=O)c1c[n-]c2ncccc12.[Y].
What is the InChIKey of N-methylpyrrolo[2,3-b]pyridin-1-ide-3-carboxamide;yttrium?
The InChIKey is YEYPWKCXHZBCFA-UHFFFAOYSA-M. The full InChI is InChI=1S/C9H9N3O.Y/c1-10-9(13)7-5-12-8-6(7)3-2-4-11-8;/h2-5H,1H3,(H2,10,11,12,13);/p-1.
What are the key properties of N-methylpyrrolo[2,3-b]pyridin-1-ide-3-carboxamide;yttrium?
N-methylpyrrolo[2,3-b]pyridin-1-ide-3-carboxamide;yttrium has a molecular weight of 263.09 g/mol, XLogP of 0.55, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylpyrrolo[2,3-b]pyridin-1-ide-3-carboxamide;yttrium is sourced from PubChem (CID 58011342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).