5-(imidazol-1-ylmethyl)-2-naphthalen-2-ylpyridine

C19H15N3 — CID 57329709

IUPAC5-(imidazol-1-ylmethyl)-2-naphthalen-2-ylpyridine
SMILESc1ccc2cc(-c3ccc(Cn4ccnc4)cn3)ccc2c1
InChIInChI=1S/C19H15N3/c1-2-4-17-11-18(7-6-16(17)3-1)19-8-5-15(12-21-19)13-22-10-9-20-14-22/h1-12,14H,13H2
InChIKeyLRTLFSHCMRWKGY-UHFFFAOYSA-N
MW285.35 g/mol
LogP4.15
Rot. Bonds3

About 5-(imidazol-1-ylmethyl)-2-naphthalen-2-ylpyridine

5-(imidazol-1-ylmethyl)-2-naphthalen-2-ylpyridine (PubChem CID 57329709) has the molecular formula C19H15N3 and a molecular weight of 285.35 g/mol. Its IUPAC name is 5-(imidazol-1-ylmethyl)-2-naphthalen-2-ylpyridine.

Molecular Properties

Compound Name5-(imidazol-1-ylmethyl)-2-naphthalen-2-ylpyridine
PubChem CID57329709
Molecular FormulaC19H15N3
Molecular Weight285.35 g/mol
Exact Mass285.13
IUPAC Name5-(imidazol-1-ylmethyl)-2-naphthalen-2-ylpyridine
SMILESc1ccc2cc(-c3ccc(Cn4ccnc4)cn3)ccc2c1
InChIInChI=1S/C19H15N3/c1-2-4-17-11-18(7-6-16(17)3-1)19-8-5-15(12-21-19)13-22-10-9-20-14-22/h1-12,14H,13H2
InChIKeyLRTLFSHCMRWKGY-UHFFFAOYSA-N
XLogP4.15
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(imidazol-1-ylmethyl)-2-naphthalen-2-ylpyridine?
The IUPAC name of 5-(imidazol-1-ylmethyl)-2-naphthalen-2-ylpyridine (CID 57329709) is 5-(imidazol-1-ylmethyl)-2-naphthalen-2-ylpyridine.
What is the SMILES notation for 5-(imidazol-1-ylmethyl)-2-naphthalen-2-ylpyridine?
The canonical SMILES for 5-(imidazol-1-ylmethyl)-2-naphthalen-2-ylpyridine is c1ccc2cc(-c3ccc(Cn4ccnc4)cn3)ccc2c1.
What is the InChIKey of 5-(imidazol-1-ylmethyl)-2-naphthalen-2-ylpyridine?
The InChIKey is LRTLFSHCMRWKGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3/c1-2-4-17-11-18(7-6-16(17)3-1)19-8-5-15(12-21-19)13-22-10-9-20-14-22/h1-12,14H,13H2.
What are the key properties of 5-(imidazol-1-ylmethyl)-2-naphthalen-2-ylpyridine?
5-(imidazol-1-ylmethyl)-2-naphthalen-2-ylpyridine has a molecular weight of 285.35 g/mol, XLogP of 4.15, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(imidazol-1-ylmethyl)-2-naphthalen-2-ylpyridine is sourced from PubChem (CID 57329709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).