3-[5-(4-chlorophenyl)-1H-imidazol-2-yl]pyridine

C14H10ClN3 — CID 10332613

IUPAC3-[5-(4-chlorophenyl)-1H-imidazol-2-yl]pyridine
SMILESClc1ccc(-c2cnc(-c3cccnc3)[nH]2)cc1
InChIInChI=1S/C14H10ClN3/c15-12-5-3-10(4-6-12)13-9-17-14(18-13)11-2-1-7-16-8-11/h1-9H,(H,17,18)
InChIKeyLJEJKDGGXSDXOV-UHFFFAOYSA-N
MW255.71 g/mol
LogP3.79
Rot. Bonds2

About 3-[5-(4-chlorophenyl)-1H-imidazol-2-yl]pyridine

3-[5-(4-chlorophenyl)-1H-imidazol-2-yl]pyridine (PubChem CID 10332613) has the molecular formula C14H10ClN3 and a molecular weight of 255.71 g/mol. Its IUPAC name is 3-[5-(4-chlorophenyl)-1H-imidazol-2-yl]pyridine.

Molecular Properties

Compound Name3-[5-(4-chlorophenyl)-1H-imidazol-2-yl]pyridine
PubChem CID10332613
Molecular FormulaC14H10ClN3
Molecular Weight255.71 g/mol
Exact Mass255.06
IUPAC Name3-[5-(4-chlorophenyl)-1H-imidazol-2-yl]pyridine
SMILESClc1ccc(-c2cnc(-c3cccnc3)[nH]2)cc1
InChIInChI=1S/C14H10ClN3/c15-12-5-3-10(4-6-12)13-9-17-14(18-13)11-2-1-7-16-8-11/h1-9H,(H,17,18)
InChIKeyLJEJKDGGXSDXOV-UHFFFAOYSA-N
XLogP3.79
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.71
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-[5-(4-chlorophenyl)-1H-imidazol-2-yl]pyridine?
The IUPAC name of 3-[5-(4-chlorophenyl)-1H-imidazol-2-yl]pyridine (CID 10332613) is 3-[5-(4-chlorophenyl)-1H-imidazol-2-yl]pyridine.
What is the SMILES notation for 3-[5-(4-chlorophenyl)-1H-imidazol-2-yl]pyridine?
The canonical SMILES for 3-[5-(4-chlorophenyl)-1H-imidazol-2-yl]pyridine is Clc1ccc(-c2cnc(-c3cccnc3)[nH]2)cc1.
What is the InChIKey of 3-[5-(4-chlorophenyl)-1H-imidazol-2-yl]pyridine?
The InChIKey is LJEJKDGGXSDXOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClN3/c15-12-5-3-10(4-6-12)13-9-17-14(18-13)11-2-1-7-16-8-11/h1-9H,(H,17,18).
What are the key properties of 3-[5-(4-chlorophenyl)-1H-imidazol-2-yl]pyridine?
3-[5-(4-chlorophenyl)-1H-imidazol-2-yl]pyridine has a molecular weight of 255.71 g/mol, XLogP of 3.79, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(4-chlorophenyl)-1H-imidazol-2-yl]pyridine is sourced from PubChem (CID 10332613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).