N-[6-(4-methoxyanilino)-3-pyridinyl]propanamide

C15H17N3O2 — CID 113019477

IUPACN-[6-(4-methoxyanilino)-3-pyridinyl]propanamide
SMILESCCC(=O)Nc1ccc(Nc2ccc(OC)cc2)nc1
InChIInChI=1S/C15H17N3O2/c1-3-15(19)18-12-6-9-14(16-10-12)17-11-4-7-13(20-2)8-5-11/h4-10H,3H2,1-2H3,(H,16,17)(H,18,19)
InChIKeyJAPGFDKDYXLEDD-UHFFFAOYSA-N
MW271.32 g/mol
LogP3.18
Rot. Bonds5

About N-[6-(4-methoxyanilino)-3-pyridinyl]propanamide

N-[6-(4-methoxyanilino)-3-pyridinyl]propanamide (PubChem CID 113019477) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is N-[6-(4-methoxyanilino)-3-pyridinyl]propanamide.

Molecular Properties

Compound NameN-[6-(4-methoxyanilino)-3-pyridinyl]propanamide
PubChem CID113019477
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC NameN-[6-(4-methoxyanilino)-3-pyridinyl]propanamide
SMILESCCC(=O)Nc1ccc(Nc2ccc(OC)cc2)nc1
InChIInChI=1S/C15H17N3O2/c1-3-15(19)18-12-6-9-14(16-10-12)17-11-4-7-13(20-2)8-5-11/h4-10H,3H2,1-2H3,(H,16,17)(H,18,19)
InChIKeyJAPGFDKDYXLEDD-UHFFFAOYSA-N
XLogP3.18
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-(3-methoxyanilino)-3-pyridinyl]propanamide
CID 113019375
N-[6-(4-fluoroanilino)-3-pyridinyl]propanamide
CID 113018289
N-[6-(4-methoxyanilino)pyridazin-3-yl]propanamide
CID 113048275
N-[6-(4-methoxyanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide
CID 113019533
2,6-dimethoxy-N-[6-(4-methoxyanilino)-3-pyridinyl]benzamide
CID 113019504
N-[6-(4-ethoxyanilino)-3-pyridinyl]acetamide
CID 113019659
N-[6-(4-ethoxyanilino)-3-pyridinyl]-3-methylbutanamide
CID 113019664
2-fluoro-N-[6-(4-methoxyanilino)-3-pyridinyl]benzamide
CID 113019493
3-bromo-N-[6-(4-methoxyanilino)-3-pyridinyl]benzamide
CID 113019497
methyl 4-[[5-(butanoylamino)-2-pyridinyl]amino]benzoate
CID 113020725
N-[6-(4-ethoxyanilino)-3-pyridinyl]-2-(4-fluorophenyl)acetamide
CID 113019688
N-[6-(2,5-dimethoxyanilino)-3-pyridinyl]-2-(4-methoxyphenyl)acetamide
CID 113019975

Frequently Asked Questions

What is the IUPAC name of N-[6-(4-methoxyanilino)-3-pyridinyl]propanamide?
The IUPAC name of N-[6-(4-methoxyanilino)-3-pyridinyl]propanamide (CID 113019477) is N-[6-(4-methoxyanilino)-3-pyridinyl]propanamide.
What is the SMILES notation for N-[6-(4-methoxyanilino)-3-pyridinyl]propanamide?
The canonical SMILES for N-[6-(4-methoxyanilino)-3-pyridinyl]propanamide is CCC(=O)Nc1ccc(Nc2ccc(OC)cc2)nc1.
What is the InChIKey of N-[6-(4-methoxyanilino)-3-pyridinyl]propanamide?
The InChIKey is JAPGFDKDYXLEDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-3-15(19)18-12-6-9-14(16-10-12)17-11-4-7-13(20-2)8-5-11/h4-10H,3H2,1-2H3,(H,16,17)(H,18,19).
What are the key properties of N-[6-(4-methoxyanilino)-3-pyridinyl]propanamide?
N-[6-(4-methoxyanilino)-3-pyridinyl]propanamide has a molecular weight of 271.32 g/mol, XLogP of 3.18, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(4-methoxyanilino)-3-pyridinyl]propanamide is sourced from PubChem (CID 113019477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).