4-methyl-1-phenyl-3,4-dihydro-2H-pyridine

C12H15N — CID 123659358

IUPAC4-methyl-1-phenyl-3,4-dihydro-2H-pyridine
SMILESCC1C=CN(c2ccccc2)CC1
InChIInChI=1S/C12H15N/c1-11-7-9-13(10-8-11)12-5-3-2-4-6-12/h2-7,9,11H,8,10H2,1H3
InChIKeyBLCHZTLRTKUPKV-UHFFFAOYSA-N
MW173.26 g/mol
LogP3.05
Rot. Bonds1

About 4-methyl-1-phenyl-3,4-dihydro-2H-pyridine

4-methyl-1-phenyl-3,4-dihydro-2H-pyridine (PubChem CID 123659358) has the molecular formula C12H15N and a molecular weight of 173.26 g/mol. Its IUPAC name is 4-methyl-1-phenyl-3,4-dihydro-2H-pyridine.

Molecular Properties

Compound Name4-methyl-1-phenyl-3,4-dihydro-2H-pyridine
PubChem CID123659358
Molecular FormulaC12H15N
Molecular Weight173.26 g/mol
Exact Mass173.12
IUPAC Name4-methyl-1-phenyl-3,4-dihydro-2H-pyridine
SMILESCC1C=CN(c2ccccc2)CC1
InChIInChI=1S/C12H15N/c1-11-7-9-13(10-8-11)12-5-3-2-4-6-12/h2-7,9,11H,8,10H2,1H3
InChIKeyBLCHZTLRTKUPKV-UHFFFAOYSA-N
XLogP3.05
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-phenyl-3,4-dihydro-2H-pyridine?
The IUPAC name of 4-methyl-1-phenyl-3,4-dihydro-2H-pyridine (CID 123659358) is 4-methyl-1-phenyl-3,4-dihydro-2H-pyridine.
What is the SMILES notation for 4-methyl-1-phenyl-3,4-dihydro-2H-pyridine?
The canonical SMILES for 4-methyl-1-phenyl-3,4-dihydro-2H-pyridine is CC1C=CN(c2ccccc2)CC1.
What is the InChIKey of 4-methyl-1-phenyl-3,4-dihydro-2H-pyridine?
The InChIKey is BLCHZTLRTKUPKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N/c1-11-7-9-13(10-8-11)12-5-3-2-4-6-12/h2-7,9,11H,8,10H2,1H3.
What are the key properties of 4-methyl-1-phenyl-3,4-dihydro-2H-pyridine?
4-methyl-1-phenyl-3,4-dihydro-2H-pyridine has a molecular weight of 173.26 g/mol, XLogP of 3.05, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-phenyl-3,4-dihydro-2H-pyridine is sourced from PubChem (CID 123659358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).