N-(4-chlorophenyl)-6-quinolin-4-yloxynaphthalene-1-carboxamide

C26H17ClN2O2 — CID 24822267

IUPACN-(4-chlorophenyl)-6-quinolin-4-yloxynaphthalene-1-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1)c1cccc2cc(Oc3ccnc4ccccc34)ccc12
InChIInChI=1S/C26H17ClN2O2/c27-18-8-10-19(11-9-18)29-26(30)22-6-3-4-17-16-20(12-13-21(17)22)31-25-14-15-28-24-7-2-1-5-23(24)25/h1-16H,(H,29,30)
InChIKeyGWEYWJXZYOROAI-UHFFFAOYSA-N
MW424.89 g/mol
LogP7.09
Rot. Bonds4

About N-(4-chlorophenyl)-6-quinolin-4-yloxynaphthalene-1-carboxamide

N-(4-chlorophenyl)-6-quinolin-4-yloxynaphthalene-1-carboxamide (PubChem CID 24822267) has the molecular formula C26H17ClN2O2 and a molecular weight of 424.89 g/mol. Its IUPAC name is N-(4-chlorophenyl)-6-quinolin-4-yloxynaphthalene-1-carboxamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-6-quinolin-4-yloxynaphthalene-1-carboxamide
PubChem CID24822267
Molecular FormulaC26H17ClN2O2
Molecular Weight424.89 g/mol
Exact Mass424.10
IUPAC NameN-(4-chlorophenyl)-6-quinolin-4-yloxynaphthalene-1-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1)c1cccc2cc(Oc3ccnc4ccccc34)ccc12
InChIInChI=1S/C26H17ClN2O2/c27-18-8-10-19(11-9-18)29-26(30)22-6-3-4-17-16-20(12-13-21(17)22)31-25-14-15-28-24-7-2-1-5-23(24)25/h1-16H,(H,29,30)
InChIKeyGWEYWJXZYOROAI-UHFFFAOYSA-N
XLogP7.09
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500424.89
LogP ≤ 57.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-6-quinolin-4-yloxynaphthalene-1-carboxamide?
The IUPAC name of N-(4-chlorophenyl)-6-quinolin-4-yloxynaphthalene-1-carboxamide (CID 24822267) is N-(4-chlorophenyl)-6-quinolin-4-yloxynaphthalene-1-carboxamide.
What is the SMILES notation for N-(4-chlorophenyl)-6-quinolin-4-yloxynaphthalene-1-carboxamide?
The canonical SMILES for N-(4-chlorophenyl)-6-quinolin-4-yloxynaphthalene-1-carboxamide is O=C(Nc1ccc(Cl)cc1)c1cccc2cc(Oc3ccnc4ccccc34)ccc12.
What is the InChIKey of N-(4-chlorophenyl)-6-quinolin-4-yloxynaphthalene-1-carboxamide?
The InChIKey is GWEYWJXZYOROAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H17ClN2O2/c27-18-8-10-19(11-9-18)29-26(30)22-6-3-4-17-16-20(12-13-21(17)22)31-25-14-15-28-24-7-2-1-5-23(24)25/h1-16H,(H,29,30).
What are the key properties of N-(4-chlorophenyl)-6-quinolin-4-yloxynaphthalene-1-carboxamide?
N-(4-chlorophenyl)-6-quinolin-4-yloxynaphthalene-1-carboxamide has a molecular weight of 424.89 g/mol, XLogP of 7.09, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-6-quinolin-4-yloxynaphthalene-1-carboxamide is sourced from PubChem (CID 24822267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).