2-chloro-6-methoxy-N-(4-methoxyphenyl)pyridine-4-carboxamide

C14H13ClN2O3 — CID 84580985

IUPAC2-chloro-6-methoxy-N-(4-methoxyphenyl)pyridine-4-carboxamide
SMILESCOc1ccc(NC(=O)c2cc(Cl)nc(OC)c2)cc1
InChIInChI=1S/C14H13ClN2O3/c1-19-11-5-3-10(4-6-11)16-14(18)9-7-12(15)17-13(8-9)20-2/h3-8H,1-2H3,(H,16,18)
InChIKeyUTWVKWKQYNXXQS-UHFFFAOYSA-N
MW292.72 g/mol
LogP3.00
Rot. Bonds4

About 2-chloro-6-methoxy-N-(4-methoxyphenyl)pyridine-4-carboxamide

2-chloro-6-methoxy-N-(4-methoxyphenyl)pyridine-4-carboxamide (PubChem CID 84580985) has the molecular formula C14H13ClN2O3 and a molecular weight of 292.72 g/mol. Its IUPAC name is 2-chloro-6-methoxy-N-(4-methoxyphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-chloro-6-methoxy-N-(4-methoxyphenyl)pyridine-4-carboxamide
PubChem CID84580985
Molecular FormulaC14H13ClN2O3
Molecular Weight292.72 g/mol
Exact Mass292.06
IUPAC Name2-chloro-6-methoxy-N-(4-methoxyphenyl)pyridine-4-carboxamide
SMILESCOc1ccc(NC(=O)c2cc(Cl)nc(OC)c2)cc1
InChIInChI=1S/C14H13ClN2O3/c1-19-11-5-3-10(4-6-11)16-14(18)9-7-12(15)17-13(8-9)20-2/h3-8H,1-2H3,(H,16,18)
InChIKeyUTWVKWKQYNXXQS-UHFFFAOYSA-N
XLogP3.00
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.72
LogP ≤ 53.00
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

2-chloro-N-[4-[chloro(difluoro)methoxy]phenyl]-6-methoxypyridine-4-carboxamide
CID 166563677
2-chloro-6-(ethylamino)-N-(4-methoxyphenyl)pyridine-4-carboxamide
CID 62171252
2-chloro-6-methoxy-N-[1-(4-methoxyphenyl)ethyl]pyridine-4-carboxamide
CID 84575899
methyl 4-[(2,6-dichloropyridine-4-carbonyl)amino]benzoate
CID 26098317
2,6-dichloro-N-[4-(trifluoromethoxy)phenyl]pyridine-4-carboxamide
CID 26289080
3,5-dibromo-N-(4-methoxyphenyl)benzamide
CID 114023535
2,6-dichloro-N-[4-[4-(4-methoxyphenyl)pyrazol-1-yl]phenyl]pyridine-4-carboxamide
CID 4091148
6-methoxy-N-(4-methoxyphenyl)pyrimidine-4-carboxamide
CID 121167255
3-chloro-4-methoxy-N-(4-methoxyphenyl)benzamide
CID 44871411
4-N-(4-chlorophenyl)-2-N-(4-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109092859
2-chloro-N-(3-methoxyphenyl)-6-(methylamino)pyridine-4-carboxamide
CID 62167485
N-(4-chlorophenyl)-4-(4-methoxyphenoxy)benzamide
CID 16651140

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-methoxy-N-(4-methoxyphenyl)pyridine-4-carboxamide?
The IUPAC name of 2-chloro-6-methoxy-N-(4-methoxyphenyl)pyridine-4-carboxamide (CID 84580985) is 2-chloro-6-methoxy-N-(4-methoxyphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-chloro-6-methoxy-N-(4-methoxyphenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-chloro-6-methoxy-N-(4-methoxyphenyl)pyridine-4-carboxamide is COc1ccc(NC(=O)c2cc(Cl)nc(OC)c2)cc1.
What is the InChIKey of 2-chloro-6-methoxy-N-(4-methoxyphenyl)pyridine-4-carboxamide?
The InChIKey is UTWVKWKQYNXXQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O3/c1-19-11-5-3-10(4-6-11)16-14(18)9-7-12(15)17-13(8-9)20-2/h3-8H,1-2H3,(H,16,18).
What are the key properties of 2-chloro-6-methoxy-N-(4-methoxyphenyl)pyridine-4-carboxamide?
2-chloro-6-methoxy-N-(4-methoxyphenyl)pyridine-4-carboxamide has a molecular weight of 292.72 g/mol, XLogP of 3.00, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-methoxy-N-(4-methoxyphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 84580985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).