N-(3-chloro-4-methoxyphenyl)-6-(morpholine-4-carbonyl)pyridine-2-carboxamide

C18H18ClN3O4 — CID 109096074

IUPACN-(3-chloro-4-methoxyphenyl)-6-(morpholine-4-carbonyl)pyridine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2cccc(C(=O)N3CCOCC3)n2)cc1Cl
InChIInChI=1S/C18H18ClN3O4/c1-25-16-6-5-12(11-13(16)19)20-17(23)14-3-2-4-15(21-14)18(24)22-7-9-26-10-8-22/h2-6,11H,7-10H2,1H3,(H,20,23)
InChIKeyJYJIPGRHIDMCGH-UHFFFAOYSA-N
MW375.81 g/mol
LogP2.47
Rot. Bonds4

About N-(3-chloro-4-methoxyphenyl)-6-(morpholine-4-carbonyl)pyridine-2-carboxamide

N-(3-chloro-4-methoxyphenyl)-6-(morpholine-4-carbonyl)pyridine-2-carboxamide (PubChem CID 109096074) has the molecular formula C18H18ClN3O4 and a molecular weight of 375.81 g/mol. Its IUPAC name is N-(3-chloro-4-methoxyphenyl)-6-(morpholine-4-carbonyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-chloro-4-methoxyphenyl)-6-(morpholine-4-carbonyl)pyridine-2-carboxamide
PubChem CID109096074
Molecular FormulaC18H18ClN3O4
Molecular Weight375.81 g/mol
Exact Mass375.10
IUPAC NameN-(3-chloro-4-methoxyphenyl)-6-(morpholine-4-carbonyl)pyridine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2cccc(C(=O)N3CCOCC3)n2)cc1Cl
InChIInChI=1S/C18H18ClN3O4/c1-25-16-6-5-12(11-13(16)19)20-17(23)14-3-2-4-15(21-14)18(24)22-7-9-26-10-8-22/h2-6,11H,7-10H2,1H3,(H,20,23)
InChIKeyJYJIPGRHIDMCGH-UHFFFAOYSA-N
XLogP2.47
TPSA80.76 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.81
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-[(3-chloro-4-methoxyphenyl)carbamoyl]pyridine-2-carboxylic acid
CID 43558305
N-(3-chloro-4-methoxyphenyl)-6-pyrrolidin-1-ylpyridine-2-carboxamide
CID 84573514
N-(3,4-dimethoxyphenyl)-6-(4-ethylpiperazine-1-carbonyl)pyridine-2-carboxamide
CID 109096866
N-(3,4-dimethoxyphenyl)-6-morpholin-4-ylpyridine-2-carboxamide
CID 84573864
6-bromo-N-(3-chloro-4-methoxyphenyl)pyridine-2-carboxamide
CID 113343016
N-(3-chloro-4-methoxyphenyl)-5-morpholin-4-ylpyridine-2-carboxamide
CID 109184851
N-(3-chloro-4-methoxyphenyl)-3-morpholin-4-yl-3-oxopropanamide
CID 108943532
6-(azepane-1-carbonyl)-N-(3-chloro-4-methylphenyl)pyridine-2-carboxamide
CID 109099901
methyl 6-(morpholine-4-carbonyl)pyridine-2-carboxylate
CID 47244996
N-(3-chloro-4-methoxyphenyl)-5-(2-morpholin-4-ylethylamino)pyridine-2-carboxamide
CID 109185866
6-N-(3-chloro-4-methoxyphenyl)-2-N-[3-(dimethylamino)propyl]pyridine-2,6-dicarboxamide
CID 109096594
N-(2,3-dimethylphenyl)-6-(morpholine-4-carbonyl)pyridine-2-carboxamide
CID 109096051

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-methoxyphenyl)-6-(morpholine-4-carbonyl)pyridine-2-carboxamide?
The IUPAC name of N-(3-chloro-4-methoxyphenyl)-6-(morpholine-4-carbonyl)pyridine-2-carboxamide (CID 109096074) is N-(3-chloro-4-methoxyphenyl)-6-(morpholine-4-carbonyl)pyridine-2-carboxamide.
What is the SMILES notation for N-(3-chloro-4-methoxyphenyl)-6-(morpholine-4-carbonyl)pyridine-2-carboxamide?
The canonical SMILES for N-(3-chloro-4-methoxyphenyl)-6-(morpholine-4-carbonyl)pyridine-2-carboxamide is COc1ccc(NC(=O)c2cccc(C(=O)N3CCOCC3)n2)cc1Cl.
What is the InChIKey of N-(3-chloro-4-methoxyphenyl)-6-(morpholine-4-carbonyl)pyridine-2-carboxamide?
The InChIKey is JYJIPGRHIDMCGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18ClN3O4/c1-25-16-6-5-12(11-13(16)19)20-17(23)14-3-2-4-15(21-14)18(24)22-7-9-26-10-8-22/h2-6,11H,7-10H2,1H3,(H,20,23).
What are the key properties of N-(3-chloro-4-methoxyphenyl)-6-(morpholine-4-carbonyl)pyridine-2-carboxamide?
N-(3-chloro-4-methoxyphenyl)-6-(morpholine-4-carbonyl)pyridine-2-carboxamide has a molecular weight of 375.81 g/mol, XLogP of 2.47, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-methoxyphenyl)-6-(morpholine-4-carbonyl)pyridine-2-carboxamide is sourced from PubChem (CID 109096074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).