3-(2-aminophenoxy)-N-(1-methyl-6-oxo-3-pyridinyl)propanamide

C15H17N3O3 — CID 61103909

IUPAC3-(2-aminophenoxy)-N-(1-methyl-6-oxo-3-pyridinyl)propanamide
SMILESCn1cc(NC(=O)CCOc2ccccc2N)ccc1=O
InChIInChI=1S/C15H17N3O3/c1-18-10-11(6-7-15(18)20)17-14(19)8-9-21-13-5-3-2-4-12(13)16/h2-7,10H,8-9,16H2,1H3,(H,17,19)
InChIKeyQYYPFEZHRVTCGR-UHFFFAOYSA-N
MW287.32 g/mol
LogP1.38
Rot. Bonds5

About 3-(2-aminophenoxy)-N-(1-methyl-6-oxo-3-pyridinyl)propanamide

3-(2-aminophenoxy)-N-(1-methyl-6-oxo-3-pyridinyl)propanamide (PubChem CID 61103909) has the molecular formula C15H17N3O3 and a molecular weight of 287.32 g/mol. Its IUPAC name is 3-(2-aminophenoxy)-N-(1-methyl-6-oxo-3-pyridinyl)propanamide.

Molecular Properties

Compound Name3-(2-aminophenoxy)-N-(1-methyl-6-oxo-3-pyridinyl)propanamide
PubChem CID61103909
Molecular FormulaC15H17N3O3
Molecular Weight287.32 g/mol
Exact Mass287.13
IUPAC Name3-(2-aminophenoxy)-N-(1-methyl-6-oxo-3-pyridinyl)propanamide
SMILESCn1cc(NC(=O)CCOc2ccccc2N)ccc1=O
InChIInChI=1S/C15H17N3O3/c1-18-10-11(6-7-15(18)20)17-14(19)8-9-21-13-5-3-2-4-12(13)16/h2-7,10H,8-9,16H2,1H3,(H,17,19)
InChIKeyQYYPFEZHRVTCGR-UHFFFAOYSA-N
XLogP1.38
TPSA86.35 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

3-(2-aminophenoxy)-N-(4-bromophenyl)propanamide
CID 61091327
4-chloro-N-(1-methyl-6-oxo-3-pyridinyl)butanamide
CID 63307637
3-(2-aminophenoxy)-N-(3,5-difluorophenyl)propanamide
CID 61092470
6-amino-N-(1-methyl-6-oxo-3-pyridinyl)hexanamide
CID 54863045
3-(3-aminophenyl)-N-(1-methyl-6-oxo-3-pyridinyl)propanamide
CID 80700526
3-(2-aminophenoxy)-N-morpholin-4-ylpropanamide
CID 83013203
N-(4-aminophenyl)-3-(2-ethoxyphenoxy)propanamide
CID 43825399
3-(2-fluorophenyl)-N-(1-methyl-6-oxo-3-pyridinyl)propanamide
CID 47067445
4-(2-aminophenoxy)-N-(3,4-dimethylphenyl)butanamide
CID 84553818
3-(2-fluorophenoxy)-N-(4-fluorophenyl)propanamide
CID 47097682
N-(1-methyl-6-oxo-3-pyridinyl)-3-(4-methylphenyl)propanamide
CID 110725063
3-(2-aminophenoxy)-N-(3,3-dimethylbutan-2-yl)propanamide
CID 104827234

Frequently Asked Questions

What is the IUPAC name of 3-(2-aminophenoxy)-N-(1-methyl-6-oxo-3-pyridinyl)propanamide?
The IUPAC name of 3-(2-aminophenoxy)-N-(1-methyl-6-oxo-3-pyridinyl)propanamide (CID 61103909) is 3-(2-aminophenoxy)-N-(1-methyl-6-oxo-3-pyridinyl)propanamide.
What is the SMILES notation for 3-(2-aminophenoxy)-N-(1-methyl-6-oxo-3-pyridinyl)propanamide?
The canonical SMILES for 3-(2-aminophenoxy)-N-(1-methyl-6-oxo-3-pyridinyl)propanamide is Cn1cc(NC(=O)CCOc2ccccc2N)ccc1=O.
What is the InChIKey of 3-(2-aminophenoxy)-N-(1-methyl-6-oxo-3-pyridinyl)propanamide?
The InChIKey is QYYPFEZHRVTCGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O3/c1-18-10-11(6-7-15(18)20)17-14(19)8-9-21-13-5-3-2-4-12(13)16/h2-7,10H,8-9,16H2,1H3,(H,17,19).
What are the key properties of 3-(2-aminophenoxy)-N-(1-methyl-6-oxo-3-pyridinyl)propanamide?
3-(2-aminophenoxy)-N-(1-methyl-6-oxo-3-pyridinyl)propanamide has a molecular weight of 287.32 g/mol, XLogP of 1.38, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminophenoxy)-N-(1-methyl-6-oxo-3-pyridinyl)propanamide is sourced from PubChem (CID 61103909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).