3-(2-chlorophenyl)-2-propylpyridine

C14H14ClN — CID 71204387

IUPAC3-(2-chlorophenyl)-2-propylpyridine
SMILESCCCc1ncccc1-c1ccccc1Cl
InChIInChI=1S/C14H14ClN/c1-2-6-14-12(8-5-10-16-14)11-7-3-4-9-13(11)15/h3-5,7-10H,2,6H2,1H3
InChIKeyLCRUQETWPHCNTM-UHFFFAOYSA-N
MW231.73 g/mol
LogP4.35
Rot. Bonds3

About 3-(2-chlorophenyl)-2-propylpyridine

3-(2-chlorophenyl)-2-propylpyridine (PubChem CID 71204387) has the molecular formula C14H14ClN and a molecular weight of 231.73 g/mol. Its IUPAC name is 3-(2-chlorophenyl)-2-propylpyridine.

Molecular Properties

Compound Name3-(2-chlorophenyl)-2-propylpyridine
PubChem CID71204387
Molecular FormulaC14H14ClN
Molecular Weight231.73 g/mol
Exact Mass231.08
IUPAC Name3-(2-chlorophenyl)-2-propylpyridine
SMILESCCCc1ncccc1-c1ccccc1Cl
InChIInChI=1S/C14H14ClN/c1-2-6-14-12(8-5-10-16-14)11-7-3-4-9-13(11)15/h3-5,7-10H,2,6H2,1H3
InChIKeyLCRUQETWPHCNTM-UHFFFAOYSA-N
XLogP4.35
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.73
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-(2-chlorophenyl)-2-propylpyridine?
The IUPAC name of 3-(2-chlorophenyl)-2-propylpyridine (CID 71204387) is 3-(2-chlorophenyl)-2-propylpyridine.
What is the SMILES notation for 3-(2-chlorophenyl)-2-propylpyridine?
The canonical SMILES for 3-(2-chlorophenyl)-2-propylpyridine is CCCc1ncccc1-c1ccccc1Cl.
What is the InChIKey of 3-(2-chlorophenyl)-2-propylpyridine?
The InChIKey is LCRUQETWPHCNTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClN/c1-2-6-14-12(8-5-10-16-14)11-7-3-4-9-13(11)15/h3-5,7-10H,2,6H2,1H3.
What are the key properties of 3-(2-chlorophenyl)-2-propylpyridine?
3-(2-chlorophenyl)-2-propylpyridine has a molecular weight of 231.73 g/mol, XLogP of 4.35, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-chlorophenyl)-2-propylpyridine is sourced from PubChem (CID 71204387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).