1-benzhydryl-2-methyl-2H-pyridine

C19H19N — CID 100945872

IUPAC1-benzhydryl-2-methyl-2H-pyridine
SMILESCC1C=CC=CN1C(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H19N/c1-16-10-8-9-15-20(16)19(17-11-4-2-5-12-17)18-13-6-3-7-14-18/h2-16,19H,1H3
InChIKeyTUBOALVJPODYJM-UHFFFAOYSA-N
MW261.37 g/mol
LogP4.55
Rot. Bonds3

About 1-benzhydryl-2-methyl-2H-pyridine

1-benzhydryl-2-methyl-2H-pyridine (PubChem CID 100945872) has the molecular formula C19H19N and a molecular weight of 261.37 g/mol. Its IUPAC name is 1-benzhydryl-2-methyl-2H-pyridine.

Molecular Properties

Compound Name1-benzhydryl-2-methyl-2H-pyridine
PubChem CID100945872
Molecular FormulaC19H19N
Molecular Weight261.37 g/mol
Exact Mass261.15
IUPAC Name1-benzhydryl-2-methyl-2H-pyridine
SMILESCC1C=CC=CN1C(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H19N/c1-16-10-8-9-15-20(16)19(17-11-4-2-5-12-17)18-13-6-3-7-14-18/h2-16,19H,1H3
InChIKeyTUBOALVJPODYJM-UHFFFAOYSA-N
XLogP4.55
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-benzhydryl-2-methyl-2H-pyridine?
The IUPAC name of 1-benzhydryl-2-methyl-2H-pyridine (CID 100945872) is 1-benzhydryl-2-methyl-2H-pyridine.
What is the SMILES notation for 1-benzhydryl-2-methyl-2H-pyridine?
The canonical SMILES for 1-benzhydryl-2-methyl-2H-pyridine is CC1C=CC=CN1C(c1ccccc1)c1ccccc1.
What is the InChIKey of 1-benzhydryl-2-methyl-2H-pyridine?
The InChIKey is TUBOALVJPODYJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N/c1-16-10-8-9-15-20(16)19(17-11-4-2-5-12-17)18-13-6-3-7-14-18/h2-16,19H,1H3.
What are the key properties of 1-benzhydryl-2-methyl-2H-pyridine?
1-benzhydryl-2-methyl-2H-pyridine has a molecular weight of 261.37 g/mol, XLogP of 4.55, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzhydryl-2-methyl-2H-pyridine is sourced from PubChem (CID 100945872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).