6-methyl-4-phenyl-1,2-dihydropyridine

C12H13N — CID 141134775

IUPAC6-methyl-4-phenyl-1,2-dihydropyridine
SMILESCC1=CC(c2ccccc2)=CCN1
InChIInChI=1S/C12H13N/c1-10-9-12(7-8-13-10)11-5-3-2-4-6-11/h2-7,9,13H,8H2,1H3
InChIKeyDAJAPSYRMNLGPI-UHFFFAOYSA-N
MW171.24 g/mol
LogP2.58
Rot. Bonds1

About 6-methyl-4-phenyl-1,2-dihydropyridine

6-methyl-4-phenyl-1,2-dihydropyridine (PubChem CID 141134775) has the molecular formula C12H13N and a molecular weight of 171.24 g/mol. Its IUPAC name is 6-methyl-4-phenyl-1,2-dihydropyridine.

Molecular Properties

Compound Name6-methyl-4-phenyl-1,2-dihydropyridine
PubChem CID141134775
Molecular FormulaC12H13N
Molecular Weight171.24 g/mol
Exact Mass171.10
IUPAC Name6-methyl-4-phenyl-1,2-dihydropyridine
SMILESCC1=CC(c2ccccc2)=CCN1
InChIInChI=1S/C12H13N/c1-10-9-12(7-8-13-10)11-5-3-2-4-6-11/h2-7,9,13H,8H2,1H3
InChIKeyDAJAPSYRMNLGPI-UHFFFAOYSA-N
XLogP2.58
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.24
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-phenyl-1,2-dihydropyridine?
The IUPAC name of 6-methyl-4-phenyl-1,2-dihydropyridine (CID 141134775) is 6-methyl-4-phenyl-1,2-dihydropyridine.
What is the SMILES notation for 6-methyl-4-phenyl-1,2-dihydropyridine?
The canonical SMILES for 6-methyl-4-phenyl-1,2-dihydropyridine is CC1=CC(c2ccccc2)=CCN1.
What is the InChIKey of 6-methyl-4-phenyl-1,2-dihydropyridine?
The InChIKey is DAJAPSYRMNLGPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N/c1-10-9-12(7-8-13-10)11-5-3-2-4-6-11/h2-7,9,13H,8H2,1H3.
What are the key properties of 6-methyl-4-phenyl-1,2-dihydropyridine?
6-methyl-4-phenyl-1,2-dihydropyridine has a molecular weight of 171.24 g/mol, XLogP of 2.58, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-phenyl-1,2-dihydropyridine is sourced from PubChem (CID 141134775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).