N-(2-anilino-6-methoxy-3-pyridinyl)propanamide

C15H17N3O2 — CID 110178821

IUPACN-(2-anilino-6-methoxy-3-pyridinyl)propanamide
SMILESCCC(=O)Nc1ccc(OC)nc1Nc1ccccc1
InChIInChI=1S/C15H17N3O2/c1-3-13(19)17-12-9-10-14(20-2)18-15(12)16-11-7-5-4-6-8-11/h4-10H,3H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyBLWRPAFDVPZCKC-UHFFFAOYSA-N
MW271.32 g/mol
LogP3.18
Rot. Bonds5

About N-(2-anilino-6-methoxy-3-pyridinyl)propanamide

N-(2-anilino-6-methoxy-3-pyridinyl)propanamide (PubChem CID 110178821) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is N-(2-anilino-6-methoxy-3-pyridinyl)propanamide.

Molecular Properties

Compound NameN-(2-anilino-6-methoxy-3-pyridinyl)propanamide
PubChem CID110178821
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC NameN-(2-anilino-6-methoxy-3-pyridinyl)propanamide
SMILESCCC(=O)Nc1ccc(OC)nc1Nc1ccccc1
InChIInChI=1S/C15H17N3O2/c1-3-13(19)17-12-9-10-14(20-2)18-15(12)16-11-7-5-4-6-8-11/h4-10H,3H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyBLWRPAFDVPZCKC-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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Frequently Asked Questions

What is the IUPAC name of N-(2-anilino-6-methoxy-3-pyridinyl)propanamide?
The IUPAC name of N-(2-anilino-6-methoxy-3-pyridinyl)propanamide (CID 110178821) is N-(2-anilino-6-methoxy-3-pyridinyl)propanamide.
What is the SMILES notation for N-(2-anilino-6-methoxy-3-pyridinyl)propanamide?
The canonical SMILES for N-(2-anilino-6-methoxy-3-pyridinyl)propanamide is CCC(=O)Nc1ccc(OC)nc1Nc1ccccc1.
What is the InChIKey of N-(2-anilino-6-methoxy-3-pyridinyl)propanamide?
The InChIKey is BLWRPAFDVPZCKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-3-13(19)17-12-9-10-14(20-2)18-15(12)16-11-7-5-4-6-8-11/h4-10H,3H2,1-2H3,(H,16,18)(H,17,19).
What are the key properties of N-(2-anilino-6-methoxy-3-pyridinyl)propanamide?
N-(2-anilino-6-methoxy-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-(2-anilino-6-methoxy-3-pyridinyl)propanamide is sourced from PubChem (CID 110178821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).