Ethane;1-[(5-methyl-4H-pyridin-4-id-2-yl)methyl]pyridin-2-one;yttrium

Name: Ethane;1-[(5-methyl-4H-pyridin-4-id-2-yl)methyl]pyridin-2-one;yttrium — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₄H₁₇N₂OY- — CID 177234828

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPACethane;1-[(5-methyl-4H-pyridin-4-id-2-yl)methyl]pyridin-2-one;yttrium

SMILESCC.Cc1[c-]cc(Cn2ccccc2=O)nc1.[Y]

InChIInChI=1S/C12H11N2O.C2H6.Y/c1-10-5-6-11(13-8-10)9-14-7-3-2-4-12(14)15;1-2;/h2-4,6-8H,9H2,1H3;1-2H3;/q-1;;

InChIKeySMVOCARLBZMKME-UHFFFAOYSA-N

MW318.21 g/mol

LogP2.42

Rot. Bonds2

About Ethane;1-[(5-methyl-4H-pyridin-4-id-2-yl)methyl]pyridin-2-one;yttrium

Ethane;1-[(5-methyl-4H-pyridin-4-id-2-yl)methyl]pyridin-2-one;yttrium (PubChem CID 177234828) has the molecular formula C₁₄H₁₇N₂OY- and a molecular weight of 318.21 g/mol. Its IUPAC name is ethane;1-[(5-methyl-4H-pyridin-4-id-2-yl)methyl]pyridin-2-one;yttrium.

Molecular Properties

Compound Name	Ethane;1-[(5-methyl-4H-pyridin-4-id-2-yl)methyl]pyridin-2-one;yttrium
PubChem CID	177234828
Molecular Formula	C₁₄H₁₇N₂OY-
Molecular Weight	318.21 g/mol
Exact Mass	318.04
IUPAC Name	ethane;1-[(5-methyl-4H-pyridin-4-id-2-yl)methyl]pyridin-2-one;yttrium
SMILES	CC.Cc1[c-]cc(Cn2ccccc2=O)nc1.[Y]
InChI	InChI=1S/C12H11N2O.C2H6.Y/c1-10-5-6-11(13-8-10)9-14-7-3-2-4-12(14)15;1-2;/h2-4,6-8H,9H2,1H3;1-2H3;/q-1;;
InChIKey	SMVOCARLBZMKME-UHFFFAOYSA-N
XLogP	2.42
TPSA	34.89 Å²
H-Bond Donors
H-Bond Acceptors	3
Rotatable Bonds	2
Heavy Atoms	18
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	318.21
LogP ≤ 5	2.42
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of Ethane;1-[(5-methyl-4H-pyridin-4-id-2-yl)methyl]pyridin-2-one;yttrium?

The IUPAC name of Ethane;1-[(5-methyl-4H-pyridin-4-id-2-yl)methyl]pyridin-2-one;yttrium (CID 177234828) is ethane;1-[(5-methyl-4H-pyridin-4-id-2-yl)methyl]pyridin-2-one;yttrium.

What is the SMILES notation for Ethane;1-[(5-methyl-4H-pyridin-4-id-2-yl)methyl]pyridin-2-one;yttrium?

The canonical SMILES for Ethane;1-[(5-methyl-4H-pyridin-4-id-2-yl)methyl]pyridin-2-one;yttrium is CC.Cc1[c-]cc(Cn2ccccc2=O)nc1.[Y].

What is the InChIKey of Ethane;1-[(5-methyl-4H-pyridin-4-id-2-yl)methyl]pyridin-2-one;yttrium?

The InChIKey is SMVOCARLBZMKME-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N2O.C2H6.Y/c1-10-5-6-11(13-8-10)9-14-7-3-2-4-12(14)15;1-2;/h2-4,6-8H,9H2,1H3;1-2H3;/q-1;;.

What are the key properties of Ethane;1-[(5-methyl-4H-pyridin-4-id-2-yl)methyl]pyridin-2-one;yttrium?

Ethane;1-[(5-methyl-4H-pyridin-4-id-2-yl)methyl]pyridin-2-one;yttrium has a molecular weight of 318.21 g/mol, XLogP of 2.42, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for Ethane;1-[(5-methyl-4H-pyridin-4-id-2-yl)methyl]pyridin-2-one;yttrium is sourced from PubChem (CID 177234828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 177234828 — identifiers, structure, computed properties (public domain)

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