2-amino-3-methoxy-N-methyl-N-pyridin-3-ylpropanamide

C10H15N3O2 — CID 81088465

IUPAC2-amino-3-methoxy-N-methyl-N-pyridin-3-ylpropanamide
SMILESCOCC(N)C(=O)N(C)c1cccnc1
InChIInChI=1S/C10H15N3O2/c1-13(8-4-3-5-12-6-8)10(14)9(11)7-15-2/h3-6,9H,7,11H2,1-2H3
InChIKeyFYQXNHXYNSTIBP-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.02
Rot. Bonds4

About 2-amino-3-methoxy-N-methyl-N-pyridin-3-ylpropanamide

2-amino-3-methoxy-N-methyl-N-pyridin-3-ylpropanamide (PubChem CID 81088465) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 2-amino-3-methoxy-N-methyl-N-pyridin-3-ylpropanamide.

Molecular Properties

Compound Name2-amino-3-methoxy-N-methyl-N-pyridin-3-ylpropanamide
PubChem CID81088465
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name2-amino-3-methoxy-N-methyl-N-pyridin-3-ylpropanamide
SMILESCOCC(N)C(=O)N(C)c1cccnc1
InChIInChI=1S/C10H15N3O2/c1-13(8-4-3-5-12-6-8)10(14)9(11)7-15-2/h3-6,9H,7,11H2,1-2H3
InChIKeyFYQXNHXYNSTIBP-UHFFFAOYSA-N
XLogP0.02
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-3-methoxy-N-methyl-N-pyridin-3-ylpropanamide?
The IUPAC name of 2-amino-3-methoxy-N-methyl-N-pyridin-3-ylpropanamide (CID 81088465) is 2-amino-3-methoxy-N-methyl-N-pyridin-3-ylpropanamide.
What is the SMILES notation for 2-amino-3-methoxy-N-methyl-N-pyridin-3-ylpropanamide?
The canonical SMILES for 2-amino-3-methoxy-N-methyl-N-pyridin-3-ylpropanamide is COCC(N)C(=O)N(C)c1cccnc1.
What is the InChIKey of 2-amino-3-methoxy-N-methyl-N-pyridin-3-ylpropanamide?
The InChIKey is FYQXNHXYNSTIBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-13(8-4-3-5-12-6-8)10(14)9(11)7-15-2/h3-6,9H,7,11H2,1-2H3.
What are the key properties of 2-amino-3-methoxy-N-methyl-N-pyridin-3-ylpropanamide?
2-amino-3-methoxy-N-methyl-N-pyridin-3-ylpropanamide has a molecular weight of 209.25 g/mol, XLogP of 0.02, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-methoxy-N-methyl-N-pyridin-3-ylpropanamide is sourced from PubChem (CID 81088465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).