3-methyl-2-[(2S)-2-(2-methylphenyl)propyl]pyridine

C16H19N — CID 165410451

IUPAC3-methyl-2-[(2S)-2-(2-methylphenyl)propyl]pyridine
SMILESCc1ccccc1[C@@H](C)Cc1ncccc1C
InChIInChI=1S/C16H19N/c1-12-7-4-5-9-15(12)14(3)11-16-13(2)8-6-10-17-16/h4-10,14H,11H2,1-3H3/t14-/m0/s1
InChIKeyFTXQCFCPVSLYKZ-AWEZNQCLSA-N
MW225.34 g/mol
LogP4.04
Rot. Bonds3

About 3-methyl-2-[(2S)-2-(2-methylphenyl)propyl]pyridine

3-methyl-2-[(2S)-2-(2-methylphenyl)propyl]pyridine (PubChem CID 165410451) has the molecular formula C16H19N and a molecular weight of 225.34 g/mol. Its IUPAC name is 3-methyl-2-[(2S)-2-(2-methylphenyl)propyl]pyridine.

Molecular Properties

Compound Name3-methyl-2-[(2S)-2-(2-methylphenyl)propyl]pyridine
PubChem CID165410451
Molecular FormulaC16H19N
Molecular Weight225.34 g/mol
Exact Mass225.15
IUPAC Name3-methyl-2-[(2S)-2-(2-methylphenyl)propyl]pyridine
SMILESCc1ccccc1[C@@H](C)Cc1ncccc1C
InChIInChI=1S/C16H19N/c1-12-7-4-5-9-15(12)14(3)11-16-13(2)8-6-10-17-16/h4-10,14H,11H2,1-3H3/t14-/m0/s1
InChIKeyFTXQCFCPVSLYKZ-AWEZNQCLSA-N
XLogP4.04
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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3-methyl-2-[2-(1,2,4-triazol-4-yl)propyl]pyridine
CID 50957417
3-methyl-2-[(3-methyl-2-pyridinyl)methoxymethyl]pyridine
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1-(2-bromophenyl)-N-ethyl-2-(3-methyl-2-pyridinyl)ethanamine
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2-[2-chloro-2-(2-chlorofuran-3-yl)ethyl]-3-methylpyridine
CID 106690733
2-[2-(3-bromo-2-methylphenyl)-2-chloroethyl]-3-methylpyridine
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Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-[(2S)-2-(2-methylphenyl)propyl]pyridine?
The IUPAC name of 3-methyl-2-[(2S)-2-(2-methylphenyl)propyl]pyridine (CID 165410451) is 3-methyl-2-[(2S)-2-(2-methylphenyl)propyl]pyridine.
What is the SMILES notation for 3-methyl-2-[(2S)-2-(2-methylphenyl)propyl]pyridine?
The canonical SMILES for 3-methyl-2-[(2S)-2-(2-methylphenyl)propyl]pyridine is Cc1ccccc1[C@@H](C)Cc1ncccc1C.
What is the InChIKey of 3-methyl-2-[(2S)-2-(2-methylphenyl)propyl]pyridine?
The InChIKey is FTXQCFCPVSLYKZ-AWEZNQCLSA-N. The full InChI is InChI=1S/C16H19N/c1-12-7-4-5-9-15(12)14(3)11-16-13(2)8-6-10-17-16/h4-10,14H,11H2,1-3H3/t14-/m0/s1.
What are the key properties of 3-methyl-2-[(2S)-2-(2-methylphenyl)propyl]pyridine?
3-methyl-2-[(2S)-2-(2-methylphenyl)propyl]pyridine has a molecular weight of 225.34 g/mol, XLogP of 4.04, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-[(2S)-2-(2-methylphenyl)propyl]pyridine is sourced from PubChem (CID 165410451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).