N-[2-(4-phenyl-1H-imidazol-5-yl)quinolin-6-yl]acetamide

C20H16N4O — CID 50976710

IUPACN-[2-(4-phenyl-1H-imidazol-5-yl)quinolin-6-yl]acetamide
SMILESCC(=O)Nc1ccc2nc(-c3[nH]cnc3-c3ccccc3)ccc2c1
InChIInChI=1S/C20H16N4O/c1-13(25)23-16-8-10-17-15(11-16)7-9-18(24-17)20-19(21-12-22-20)14-5-3-2-4-6-14/h2-12H,1H3,(H,21,22)(H,23,25)
InChIKeyKYDFLRZCJMFSFW-UHFFFAOYSA-N
MW328.38 g/mol
LogP4.25
Rot. Bonds3

About N-[2-(4-phenyl-1H-imidazol-5-yl)quinolin-6-yl]acetamide

N-[2-(4-phenyl-1H-imidazol-5-yl)quinolin-6-yl]acetamide (PubChem CID 50976710) has the molecular formula C20H16N4O and a molecular weight of 328.38 g/mol. Its IUPAC name is N-[2-(4-phenyl-1H-imidazol-5-yl)quinolin-6-yl]acetamide.

Molecular Properties

Compound NameN-[2-(4-phenyl-1H-imidazol-5-yl)quinolin-6-yl]acetamide
PubChem CID50976710
Molecular FormulaC20H16N4O
Molecular Weight328.38 g/mol
Exact Mass328.13
IUPAC NameN-[2-(4-phenyl-1H-imidazol-5-yl)quinolin-6-yl]acetamide
SMILESCC(=O)Nc1ccc2nc(-c3[nH]cnc3-c3ccccc3)ccc2c1
InChIInChI=1S/C20H16N4O/c1-13(25)23-16-8-10-17-15(11-16)7-9-18(24-17)20-19(21-12-22-20)14-5-3-2-4-6-14/h2-12H,1H3,(H,21,22)(H,23,25)
InChIKeyKYDFLRZCJMFSFW-UHFFFAOYSA-N
XLogP4.25
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.38
LogP ≤ 54.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4-phenyl-1H-imidazol-5-yl)quinolin-6-yl]acetamide?
The IUPAC name of N-[2-(4-phenyl-1H-imidazol-5-yl)quinolin-6-yl]acetamide (CID 50976710) is N-[2-(4-phenyl-1H-imidazol-5-yl)quinolin-6-yl]acetamide.
What is the SMILES notation for N-[2-(4-phenyl-1H-imidazol-5-yl)quinolin-6-yl]acetamide?
The canonical SMILES for N-[2-(4-phenyl-1H-imidazol-5-yl)quinolin-6-yl]acetamide is CC(=O)Nc1ccc2nc(-c3[nH]cnc3-c3ccccc3)ccc2c1.
What is the InChIKey of N-[2-(4-phenyl-1H-imidazol-5-yl)quinolin-6-yl]acetamide?
The InChIKey is KYDFLRZCJMFSFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N4O/c1-13(25)23-16-8-10-17-15(11-16)7-9-18(24-17)20-19(21-12-22-20)14-5-3-2-4-6-14/h2-12H,1H3,(H,21,22)(H,23,25).
What are the key properties of N-[2-(4-phenyl-1H-imidazol-5-yl)quinolin-6-yl]acetamide?
N-[2-(4-phenyl-1H-imidazol-5-yl)quinolin-6-yl]acetamide has a molecular weight of 328.38 g/mol, XLogP of 4.25, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-phenyl-1H-imidazol-5-yl)quinolin-6-yl]acetamide is sourced from PubChem (CID 50976710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).