N-(5-chloro-2-phenoxyphenyl)-6-methoxypyridine-3-carboxamide

C19H15ClN2O3 — CID 30779619

IUPACN-(5-chloro-2-phenoxyphenyl)-6-methoxypyridine-3-carboxamide
SMILESCOc1ccc(C(=O)Nc2cc(Cl)ccc2Oc2ccccc2)cn1
InChIInChI=1S/C19H15ClN2O3/c1-24-18-10-7-13(12-21-18)19(23)22-16-11-14(20)8-9-17(16)25-15-5-3-2-4-6-15/h2-12H,1H3,(H,22,23)
InChIKeyLJQMFZAPZKIEGY-UHFFFAOYSA-N
MW354.79 g/mol
LogP4.79
Rot. Bonds5

About N-(5-chloro-2-phenoxyphenyl)-6-methoxypyridine-3-carboxamide

N-(5-chloro-2-phenoxyphenyl)-6-methoxypyridine-3-carboxamide (PubChem CID 30779619) has the molecular formula C19H15ClN2O3 and a molecular weight of 354.79 g/mol. Its IUPAC name is N-(5-chloro-2-phenoxyphenyl)-6-methoxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-phenoxyphenyl)-6-methoxypyridine-3-carboxamide
PubChem CID30779619
Molecular FormulaC19H15ClN2O3
Molecular Weight354.79 g/mol
Exact Mass354.08
IUPAC NameN-(5-chloro-2-phenoxyphenyl)-6-methoxypyridine-3-carboxamide
SMILESCOc1ccc(C(=O)Nc2cc(Cl)ccc2Oc2ccccc2)cn1
InChIInChI=1S/C19H15ClN2O3/c1-24-18-10-7-13(12-21-18)19(23)22-16-11-14(20)8-9-17(16)25-15-5-3-2-4-6-15/h2-12H,1H3,(H,22,23)
InChIKeyLJQMFZAPZKIEGY-UHFFFAOYSA-N
XLogP4.79
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.79
LogP ≤ 54.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-phenoxyphenyl)-6-methoxypyridine-3-carboxamide?
The IUPAC name of N-(5-chloro-2-phenoxyphenyl)-6-methoxypyridine-3-carboxamide (CID 30779619) is N-(5-chloro-2-phenoxyphenyl)-6-methoxypyridine-3-carboxamide.
What is the SMILES notation for N-(5-chloro-2-phenoxyphenyl)-6-methoxypyridine-3-carboxamide?
The canonical SMILES for N-(5-chloro-2-phenoxyphenyl)-6-methoxypyridine-3-carboxamide is COc1ccc(C(=O)Nc2cc(Cl)ccc2Oc2ccccc2)cn1.
What is the InChIKey of N-(5-chloro-2-phenoxyphenyl)-6-methoxypyridine-3-carboxamide?
The InChIKey is LJQMFZAPZKIEGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClN2O3/c1-24-18-10-7-13(12-21-18)19(23)22-16-11-14(20)8-9-17(16)25-15-5-3-2-4-6-15/h2-12H,1H3,(H,22,23).
What are the key properties of N-(5-chloro-2-phenoxyphenyl)-6-methoxypyridine-3-carboxamide?
N-(5-chloro-2-phenoxyphenyl)-6-methoxypyridine-3-carboxamide has a molecular weight of 354.79 g/mol, XLogP of 4.79, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-phenoxyphenyl)-6-methoxypyridine-3-carboxamide is sourced from PubChem (CID 30779619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).