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Abametapir

C12H12N2 — CID 15664

💊View drug profile → abametapir

Data last refreshed: (MolForge compound catalog, from PubChem)

IUPAC5-methyl-2-(5-methyl-2-pyridinyl)pyridine
SMILESCc1ccc(-c2ccc(C)cn2)nc1
InChIInChI=1S/C12H12N2/c1-9-3-5-11(13-7-9)12-6-4-10(2)8-14-12/h3-8H,1-2H3
InChIKeyPTRATZCAGVBFIQ-UHFFFAOYSA-N
MW184.24 g/mol
LogP2.76
Rot. Bonds1

About Abametapir

Abametapir (PubChem CID 15664) has the molecular formula C12H12N2 and a molecular weight of 184.24 g/mol. Its IUPAC name is 5-methyl-2-(5-methyl-2-pyridinyl)pyridine.

Molecular Properties

Compound NameAbametapir
PubChem CID15664
Molecular FormulaC12H12N2
Molecular Weight184.24 g/mol
Exact Mass184.10
IUPAC Name5-methyl-2-(5-methyl-2-pyridinyl)pyridine
SMILESCc1ccc(-c2ccc(C)cn2)nc1
InChIInChI=1S/C12H12N2/c1-9-3-5-11(13-7-9)12-6-4-10(2)8-14-12/h3-8H,1-2H3
InChIKeyPTRATZCAGVBFIQ-UHFFFAOYSA-N
XLogP2.76
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of Abametapir?
The IUPAC name of Abametapir (CID 15664) is 5-methyl-2-(5-methyl-2-pyridinyl)pyridine.
What is the SMILES notation for Abametapir?
The canonical SMILES for Abametapir is Cc1ccc(-c2ccc(C)cn2)nc1.
What is the InChIKey of Abametapir?
The InChIKey is PTRATZCAGVBFIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2/c1-9-3-5-11(13-7-9)12-6-4-10(2)8-14-12/h3-8H,1-2H3.
What are the key properties of Abametapir?
Abametapir has a molecular weight of 184.24 g/mol, XLogP of 2.76, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for Abametapir is sourced from PubChem (CID 15664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

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