3-methoxy-N-[2-(1-methylpyrrolidin-3-yl)oxy-3-pyridinyl]propanamide

C14H21N3O3 — CID 91904237

IUPAC3-methoxy-N-[2-(1-methylpyrrolidin-3-yl)oxy-3-pyridinyl]propanamide
SMILESCOCCC(=O)Nc1cccnc1OC1CCN(C)C1
InChIInChI=1S/C14H21N3O3/c1-17-8-5-11(10-17)20-14-12(4-3-7-15-14)16-13(18)6-9-19-2/h3-4,7,11H,5-6,8-10H2,1-2H3,(H,16,18)
InChIKeyXPXMQVJWVZGMMG-UHFFFAOYSA-N
MW279.34 g/mol
LogP1.14
Rot. Bonds6

About 3-methoxy-N-[2-(1-methylpyrrolidin-3-yl)oxy-3-pyridinyl]propanamide

3-methoxy-N-[2-(1-methylpyrrolidin-3-yl)oxy-3-pyridinyl]propanamide (PubChem CID 91904237) has the molecular formula C14H21N3O3 and a molecular weight of 279.34 g/mol. Its IUPAC name is 3-methoxy-N-[2-(1-methylpyrrolidin-3-yl)oxy-3-pyridinyl]propanamide.

Molecular Properties

Compound Name3-methoxy-N-[2-(1-methylpyrrolidin-3-yl)oxy-3-pyridinyl]propanamide
PubChem CID91904237
Molecular FormulaC14H21N3O3
Molecular Weight279.34 g/mol
Exact Mass279.16
IUPAC Name3-methoxy-N-[2-(1-methylpyrrolidin-3-yl)oxy-3-pyridinyl]propanamide
SMILESCOCCC(=O)Nc1cccnc1OC1CCN(C)C1
InChIInChI=1S/C14H21N3O3/c1-17-8-5-11(10-17)20-14-12(4-3-7-15-14)16-13(18)6-9-19-2/h3-4,7,11H,5-6,8-10H2,1-2H3,(H,16,18)
InChIKeyXPXMQVJWVZGMMG-UHFFFAOYSA-N
XLogP1.14
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[2-(1-methylpyrrolidin-3-yl)oxy-3-pyridinyl]propanamide?
The IUPAC name of 3-methoxy-N-[2-(1-methylpyrrolidin-3-yl)oxy-3-pyridinyl]propanamide (CID 91904237) is 3-methoxy-N-[2-(1-methylpyrrolidin-3-yl)oxy-3-pyridinyl]propanamide.
What is the SMILES notation for 3-methoxy-N-[2-(1-methylpyrrolidin-3-yl)oxy-3-pyridinyl]propanamide?
The canonical SMILES for 3-methoxy-N-[2-(1-methylpyrrolidin-3-yl)oxy-3-pyridinyl]propanamide is COCCC(=O)Nc1cccnc1OC1CCN(C)C1.
What is the InChIKey of 3-methoxy-N-[2-(1-methylpyrrolidin-3-yl)oxy-3-pyridinyl]propanamide?
The InChIKey is XPXMQVJWVZGMMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O3/c1-17-8-5-11(10-17)20-14-12(4-3-7-15-14)16-13(18)6-9-19-2/h3-4,7,11H,5-6,8-10H2,1-2H3,(H,16,18).
What are the key properties of 3-methoxy-N-[2-(1-methylpyrrolidin-3-yl)oxy-3-pyridinyl]propanamide?
3-methoxy-N-[2-(1-methylpyrrolidin-3-yl)oxy-3-pyridinyl]propanamide has a molecular weight of 279.34 g/mol, XLogP of 1.14, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[2-(1-methylpyrrolidin-3-yl)oxy-3-pyridinyl]propanamide is sourced from PubChem (CID 91904237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).