N-[3-(2-aminoethoxy)phenyl]-3-methoxypyridine-4-carboxamide

C15H17N3O3 — CID 105062895

IUPACN-[3-(2-aminoethoxy)phenyl]-3-methoxypyridine-4-carboxamide
SMILESCOc1cnccc1C(=O)Nc1cccc(OCCN)c1
InChIInChI=1S/C15H17N3O3/c1-20-14-10-17-7-5-13(14)15(19)18-11-3-2-4-12(9-11)21-8-6-16/h2-5,7,9-10H,6,8,16H2,1H3,(H,18,19)
InChIKeyIJUBGWTUMKGURS-UHFFFAOYSA-N
MW287.32 g/mol
LogP1.68
Rot. Bonds6

About N-[3-(2-aminoethoxy)phenyl]-3-methoxypyridine-4-carboxamide

N-[3-(2-aminoethoxy)phenyl]-3-methoxypyridine-4-carboxamide (PubChem CID 105062895) has the molecular formula C15H17N3O3 and a molecular weight of 287.32 g/mol. Its IUPAC name is N-[3-(2-aminoethoxy)phenyl]-3-methoxypyridine-4-carboxamide.

Molecular Properties

Compound NameN-[3-(2-aminoethoxy)phenyl]-3-methoxypyridine-4-carboxamide
PubChem CID105062895
Molecular FormulaC15H17N3O3
Molecular Weight287.32 g/mol
Exact Mass287.13
IUPAC NameN-[3-(2-aminoethoxy)phenyl]-3-methoxypyridine-4-carboxamide
SMILESCOc1cnccc1C(=O)Nc1cccc(OCCN)c1
InChIInChI=1S/C15H17N3O3/c1-20-14-10-17-7-5-13(14)15(19)18-11-3-2-4-12(9-11)21-8-6-16/h2-5,7,9-10H,6,8,16H2,1H3,(H,18,19)
InChIKeyIJUBGWTUMKGURS-UHFFFAOYSA-N
XLogP1.68
TPSA86.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-acetylphenyl)-3-methoxypyridine-4-carboxamide
CID 105063564
3-methoxy-N-(3-sulfamoylphenyl)pyridine-4-carboxamide
CID 105064331
N-[3-(2-aminoethoxy)phenyl]-2-fluoro-3-methylbenzamide
CID 81481242
N-[3-(2-aminoethoxy)phenyl]pyridazine-4-carboxamide
CID 104668880
N-[3-(3-hydroxyprop-1-ynyl)phenyl]-3-methoxypyridine-4-carboxamide
CID 105064266
N-[3-(2-aminoethoxy)phenyl]-2,5-dichlorobenzamide
CID 63121176
N-[3-(2-imidazol-1-ylethoxy)phenyl]-2-methoxybenzamide
CID 47045466
2,4-dimethoxy-N-(3-propoxyphenyl)benzamide
CID 34372962
N-[3-(2-aminoethoxy)phenyl]-2,5-dimethylfuran-3-carboxamide
CID 43175539
N-[3-(2-methoxyethoxy)phenyl]-2-(2-phenoxyethoxy)benzamide
CID 17169883
N-[3-(2-aminoethoxy)phenyl]-2-methoxyacetamide
CID 61277360
N-(4-amino-3-bromophenyl)-3-methoxypyridine-4-carboxamide
CID 105063037

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-aminoethoxy)phenyl]-3-methoxypyridine-4-carboxamide?
The IUPAC name of N-[3-(2-aminoethoxy)phenyl]-3-methoxypyridine-4-carboxamide (CID 105062895) is N-[3-(2-aminoethoxy)phenyl]-3-methoxypyridine-4-carboxamide.
What is the SMILES notation for N-[3-(2-aminoethoxy)phenyl]-3-methoxypyridine-4-carboxamide?
The canonical SMILES for N-[3-(2-aminoethoxy)phenyl]-3-methoxypyridine-4-carboxamide is COc1cnccc1C(=O)Nc1cccc(OCCN)c1.
What is the InChIKey of N-[3-(2-aminoethoxy)phenyl]-3-methoxypyridine-4-carboxamide?
The InChIKey is IJUBGWTUMKGURS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O3/c1-20-14-10-17-7-5-13(14)15(19)18-11-3-2-4-12(9-11)21-8-6-16/h2-5,7,9-10H,6,8,16H2,1H3,(H,18,19).
What are the key properties of N-[3-(2-aminoethoxy)phenyl]-3-methoxypyridine-4-carboxamide?
N-[3-(2-aminoethoxy)phenyl]-3-methoxypyridine-4-carboxamide has a molecular weight of 287.32 g/mol, XLogP of 1.68, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-aminoethoxy)phenyl]-3-methoxypyridine-4-carboxamide is sourced from PubChem (CID 105062895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).