6-chloro-N-[2-(4-ethoxyphenoxy)phenyl]pyridine-3-carboxamide

C20H17ClN2O3 — CID 26243696

IUPAC6-chloro-N-[2-(4-ethoxyphenoxy)phenyl]pyridine-3-carboxamide
SMILESCCOc1ccc(Oc2ccccc2NC(=O)c2ccc(Cl)nc2)cc1
InChIInChI=1S/C20H17ClN2O3/c1-2-25-15-8-10-16(11-9-15)26-18-6-4-3-5-17(18)23-20(24)14-7-12-19(21)22-13-14/h3-13H,2H2,1H3,(H,23,24)
InChIKeySAAZGKUZNOOEPC-UHFFFAOYSA-N
MW368.82 g/mol
LogP5.18
Rot. Bonds6

About 6-chloro-N-[2-(4-ethoxyphenoxy)phenyl]pyridine-3-carboxamide

6-chloro-N-[2-(4-ethoxyphenoxy)phenyl]pyridine-3-carboxamide (PubChem CID 26243696) has the molecular formula C20H17ClN2O3 and a molecular weight of 368.82 g/mol. Its IUPAC name is 6-chloro-N-[2-(4-ethoxyphenoxy)phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-chloro-N-[2-(4-ethoxyphenoxy)phenyl]pyridine-3-carboxamide
PubChem CID26243696
Molecular FormulaC20H17ClN2O3
Molecular Weight368.82 g/mol
Exact Mass368.09
IUPAC Name6-chloro-N-[2-(4-ethoxyphenoxy)phenyl]pyridine-3-carboxamide
SMILESCCOc1ccc(Oc2ccccc2NC(=O)c2ccc(Cl)nc2)cc1
InChIInChI=1S/C20H17ClN2O3/c1-2-25-15-8-10-16(11-9-15)26-18-6-4-3-5-17(18)23-20(24)14-7-12-19(21)22-13-14/h3-13H,2H2,1H3,(H,23,24)
InChIKeySAAZGKUZNOOEPC-UHFFFAOYSA-N
XLogP5.18
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.82
LogP ≤ 55.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

N-[2-(4-ethoxyphenoxy)phenyl]-4-methylbenzamide
CID 7925397
6-(cyclopropylamino)-N-[2-(4-ethoxyphenoxy)phenyl]pyridine-3-carboxamide
CID 60563554
4-acetamido-N-[2-(4-ethoxyphenoxy)phenyl]benzamide
CID 26243690
N-(6-chloro-3-pyridinyl)-4-ethoxybenzamide
CID 54787908
N-[2-(4-ethoxyphenoxy)phenyl]-1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide
CID 24673188
N-[3-[[2-(4-ethoxyphenoxy)phenyl]carbamoyl]phenyl]pyridine-3-carboxamide
CID 55630301
N-[2-(4-ethoxyphenoxy)phenyl]-4-(ethylsulfamoyl)benzamide
CID 39971958
6-chloro-N-[2-(2,2,2-trifluoroethoxy)phenyl]pyridine-3-carboxamide
CID 41369460
6-chloro-N-[5-chloro-2-(4-methoxyphenoxy)phenyl]pyridine-3-carboxamide
CID 26267192
N-[2-(4-ethoxyphenoxy)phenyl]-2-iodobenzamide
CID 26243693
6-chloro-N-(2-methylphenyl)pyridine-3-carboxamide
CID 2599141
N-[2-(4-ethoxyphenoxy)phenyl]-3-nitrobenzamide
CID 7925385

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[2-(4-ethoxyphenoxy)phenyl]pyridine-3-carboxamide?
The IUPAC name of 6-chloro-N-[2-(4-ethoxyphenoxy)phenyl]pyridine-3-carboxamide (CID 26243696) is 6-chloro-N-[2-(4-ethoxyphenoxy)phenyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-chloro-N-[2-(4-ethoxyphenoxy)phenyl]pyridine-3-carboxamide?
The canonical SMILES for 6-chloro-N-[2-(4-ethoxyphenoxy)phenyl]pyridine-3-carboxamide is CCOc1ccc(Oc2ccccc2NC(=O)c2ccc(Cl)nc2)cc1.
What is the InChIKey of 6-chloro-N-[2-(4-ethoxyphenoxy)phenyl]pyridine-3-carboxamide?
The InChIKey is SAAZGKUZNOOEPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17ClN2O3/c1-2-25-15-8-10-16(11-9-15)26-18-6-4-3-5-17(18)23-20(24)14-7-12-19(21)22-13-14/h3-13H,2H2,1H3,(H,23,24).
What are the key properties of 6-chloro-N-[2-(4-ethoxyphenoxy)phenyl]pyridine-3-carboxamide?
6-chloro-N-[2-(4-ethoxyphenoxy)phenyl]pyridine-3-carboxamide has a molecular weight of 368.82 g/mol, XLogP of 5.18, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[2-(4-ethoxyphenoxy)phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 26243696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).