3H-pyrrole;yttrium

C4H5NY — CID 59738572

IUPAC3H-pyrrole;yttrium
SMILESC1=CN=CC1.[Y]
InChIInChI=1S/C4H5N.Y/c1-2-4-5-3-1;/h1,3-4H,2H2;
InChIKeyNYGDUIOCQCKTCX-UHFFFAOYSA-N
MW156.00 g/mol
LogP0.97
Rot. Bonds

About 3H-pyrrole;yttrium

3H-pyrrole;yttrium (PubChem CID 59738572) has the molecular formula C4H5NY and a molecular weight of 156.00 g/mol. Its IUPAC name is 3H-pyrrole;yttrium.

Molecular Properties

Compound Name3H-pyrrole;yttrium
PubChem CID59738572
Molecular FormulaC4H5NY
Molecular Weight156.00 g/mol
Exact Mass155.95
IUPAC Name3H-pyrrole;yttrium
SMILESC1=CN=CC1.[Y]
InChIInChI=1S/C4H5N.Y/c1-2-4-5-3-1;/h1,3-4H,2H2;
InChIKeyNYGDUIOCQCKTCX-UHFFFAOYSA-N
XLogP0.97
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.00
LogP ≤ 50.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 3H-pyrrole;yttrium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3H-pyrrole;yttrium?
The IUPAC name of 3H-pyrrole;yttrium (CID 59738572) is 3H-pyrrole;yttrium.
What is the SMILES notation for 3H-pyrrole;yttrium?
The canonical SMILES for 3H-pyrrole;yttrium is C1=CN=CC1.[Y].
What is the InChIKey of 3H-pyrrole;yttrium?
The InChIKey is NYGDUIOCQCKTCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5N.Y/c1-2-4-5-3-1;/h1,3-4H,2H2;.
What are the key properties of 3H-pyrrole;yttrium?
3H-pyrrole;yttrium has a molecular weight of 156.00 g/mol, XLogP of 0.97, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3H-pyrrole;yttrium is sourced from PubChem (CID 59738572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).