N-(3,4-dimethoxyphenyl)-6-morpholin-4-ylpyridine-2-carboxamide

C18H21N3O4 — CID 84573864

IUPACN-(3,4-dimethoxyphenyl)-6-morpholin-4-ylpyridine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2cccc(N3CCOCC3)n2)cc1OC
InChIInChI=1S/C18H21N3O4/c1-23-15-7-6-13(12-16(15)24-2)19-18(22)14-4-3-5-17(20-14)21-8-10-25-11-9-21/h3-7,12H,8-11H2,1-2H3,(H,19,22)
InChIKeyMWWGRMJSCMMUSI-UHFFFAOYSA-N
MW343.38 g/mol
LogP2.19
Rot. Bonds5

About N-(3,4-dimethoxyphenyl)-6-morpholin-4-ylpyridine-2-carboxamide

N-(3,4-dimethoxyphenyl)-6-morpholin-4-ylpyridine-2-carboxamide (PubChem CID 84573864) has the molecular formula C18H21N3O4 and a molecular weight of 343.38 g/mol. Its IUPAC name is N-(3,4-dimethoxyphenyl)-6-morpholin-4-ylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3,4-dimethoxyphenyl)-6-morpholin-4-ylpyridine-2-carboxamide
PubChem CID84573864
Molecular FormulaC18H21N3O4
Molecular Weight343.38 g/mol
Exact Mass343.15
IUPAC NameN-(3,4-dimethoxyphenyl)-6-morpholin-4-ylpyridine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2cccc(N3CCOCC3)n2)cc1OC
InChIInChI=1S/C18H21N3O4/c1-23-15-7-6-13(12-16(15)24-2)19-18(22)14-4-3-5-17(20-14)21-8-10-25-11-9-21/h3-7,12H,8-11H2,1-2H3,(H,19,22)
InChIKeyMWWGRMJSCMMUSI-UHFFFAOYSA-N
XLogP2.19
TPSA72.92 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.38
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3,4-dimethoxyphenyl)-6-morpholin-4-ylpyridazine-3-carboxamide
CID 109114560
N-(2-methoxyphenyl)-6-morpholin-4-ylpyridine-2-carboxamide
CID 84573867
N-(4-methylphenyl)-6-morpholin-4-ylpyridine-2-carboxamide
CID 84573865
N-(3-chloro-4-methoxyphenyl)-6-pyrrolidin-1-ylpyridine-2-carboxamide
CID 84573514
N-(3-chloro-4-methoxyphenyl)-6-(morpholine-4-carbonyl)pyridine-2-carboxamide
CID 109096074
N-(3,4-dimethylphenyl)-6-pyrrolidin-1-ylpyridine-2-carboxamide
CID 84573565
6-morpholin-4-ylpyridine-2-carbohydrazide
CID 67450200
6-N-tert-butyl-2-N-(3,4-dimethoxyphenyl)pyridine-2,6-dicarboxamide
CID 109099186
6-N-(3,4-dimethoxyphenyl)-2-N-(2-methylpropyl)pyridine-2,6-dicarboxamide
CID 109094513
N-(3,4-dimethoxyphenyl)-6-(4-ethylpiperazine-1-carbonyl)pyridine-2-carboxamide
CID 109096866
N-(2,5-dimethoxyphenyl)-6-piperidin-1-ylpyridine-2-carboxamide
CID 84573662
N-(3,4-dimethoxyphenyl)-2-methyl-6-(4-methylpiperazin-1-yl)pyrimidine-4-carboxamide
CID 109366965

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethoxyphenyl)-6-morpholin-4-ylpyridine-2-carboxamide?
The IUPAC name of N-(3,4-dimethoxyphenyl)-6-morpholin-4-ylpyridine-2-carboxamide (CID 84573864) is N-(3,4-dimethoxyphenyl)-6-morpholin-4-ylpyridine-2-carboxamide.
What is the SMILES notation for N-(3,4-dimethoxyphenyl)-6-morpholin-4-ylpyridine-2-carboxamide?
The canonical SMILES for N-(3,4-dimethoxyphenyl)-6-morpholin-4-ylpyridine-2-carboxamide is COc1ccc(NC(=O)c2cccc(N3CCOCC3)n2)cc1OC.
What is the InChIKey of N-(3,4-dimethoxyphenyl)-6-morpholin-4-ylpyridine-2-carboxamide?
The InChIKey is MWWGRMJSCMMUSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O4/c1-23-15-7-6-13(12-16(15)24-2)19-18(22)14-4-3-5-17(20-14)21-8-10-25-11-9-21/h3-7,12H,8-11H2,1-2H3,(H,19,22).
What are the key properties of N-(3,4-dimethoxyphenyl)-6-morpholin-4-ylpyridine-2-carboxamide?
N-(3,4-dimethoxyphenyl)-6-morpholin-4-ylpyridine-2-carboxamide has a molecular weight of 343.38 g/mol, XLogP of 2.19, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethoxyphenyl)-6-morpholin-4-ylpyridine-2-carboxamide is sourced from PubChem (CID 84573864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).