(2R)-1-methyl-2-(2-methylphenyl)-4-propan-2-yl-2H-pyridine

C16H21N — CID 134525295

IUPAC(2R)-1-methyl-2-(2-methylphenyl)-4-propan-2-yl-2H-pyridine
SMILESCc1ccccc1[C@H]1C=C(C(C)C)C=CN1C
InChIInChI=1S/C16H21N/c1-12(2)14-9-10-17(4)16(11-14)15-8-6-5-7-13(15)3/h5-12,16H,1-4H3/t16-/m1/s1
InChIKeyBLZDPITXFDPABZ-MRXNPFEDSA-N
MW227.35 g/mol
LogP4.08
Rot. Bonds2

About (2R)-1-methyl-2-(2-methylphenyl)-4-propan-2-yl-2H-pyridine

(2R)-1-methyl-2-(2-methylphenyl)-4-propan-2-yl-2H-pyridine (PubChem CID 134525295) has the molecular formula C16H21N and a molecular weight of 227.35 g/mol. Its IUPAC name is (2R)-1-methyl-2-(2-methylphenyl)-4-propan-2-yl-2H-pyridine.

Molecular Properties

Compound Name(2R)-1-methyl-2-(2-methylphenyl)-4-propan-2-yl-2H-pyridine
PubChem CID134525295
Molecular FormulaC16H21N
Molecular Weight227.35 g/mol
Exact Mass227.17
IUPAC Name(2R)-1-methyl-2-(2-methylphenyl)-4-propan-2-yl-2H-pyridine
SMILESCc1ccccc1[C@H]1C=C(C(C)C)C=CN1C
InChIInChI=1S/C16H21N/c1-12(2)14-9-10-17(4)16(11-14)15-8-6-5-7-13(15)3/h5-12,16H,1-4H3/t16-/m1/s1
InChIKeyBLZDPITXFDPABZ-MRXNPFEDSA-N
XLogP4.08
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2R)-1-methyl-2-(2-methylphenyl)-4-propan-2-yl-2H-pyridine?
The IUPAC name of (2R)-1-methyl-2-(2-methylphenyl)-4-propan-2-yl-2H-pyridine (CID 134525295) is (2R)-1-methyl-2-(2-methylphenyl)-4-propan-2-yl-2H-pyridine.
What is the SMILES notation for (2R)-1-methyl-2-(2-methylphenyl)-4-propan-2-yl-2H-pyridine?
The canonical SMILES for (2R)-1-methyl-2-(2-methylphenyl)-4-propan-2-yl-2H-pyridine is Cc1ccccc1[C@H]1C=C(C(C)C)C=CN1C.
What is the InChIKey of (2R)-1-methyl-2-(2-methylphenyl)-4-propan-2-yl-2H-pyridine?
The InChIKey is BLZDPITXFDPABZ-MRXNPFEDSA-N. The full InChI is InChI=1S/C16H21N/c1-12(2)14-9-10-17(4)16(11-14)15-8-6-5-7-13(15)3/h5-12,16H,1-4H3/t16-/m1/s1.
What are the key properties of (2R)-1-methyl-2-(2-methylphenyl)-4-propan-2-yl-2H-pyridine?
(2R)-1-methyl-2-(2-methylphenyl)-4-propan-2-yl-2H-pyridine has a molecular weight of 227.35 g/mol, XLogP of 4.08, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-methyl-2-(2-methylphenyl)-4-propan-2-yl-2H-pyridine is sourced from PubChem (CID 134525295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).