Methyl 3-[[(2R)-oxolan-2-yl]methyl-(pyridine-3-carbonyl)amino]propanoate

Name: Methyl 3-[[(2R)-oxolan-2-yl]methyl-(pyridine-3-carbonyl)amino]propanoate — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₅H₂₀N₂O₄ — CID 95480071

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPACmethyl 3-[[(2R)-oxolan-2-yl]methyl-(pyridine-3-carbonyl)amino]propanoate

SMILESCOC(=O)CCN(C[C@H]1CCCO1)C(=O)c1cccnc1

InChIInChI=1S/C15H20N2O4/c1-20-14(18)6-8-17(11-13-5-3-9-21-13)15(19)12-4-2-7-16-10-12/h2,4,7,10,13H,3,5-6,8-9,11H2,1H3/t13-/m1/s1

InChIKeyDEOWZZXUZDOEJY-CYBMUJFWSA-N

MW292.33 g/mol

LogP1.27

Rot. Bonds6

About Methyl 3-[[(2R)-oxolan-2-yl]methyl-(pyridine-3-carbonyl)amino]propanoate

Methyl 3-[[(2R)-oxolan-2-yl]methyl-(pyridine-3-carbonyl)amino]propanoate (PubChem CID 95480071) has the molecular formula C₁₅H₂₀N₂O₄ and a molecular weight of 292.33 g/mol. Its IUPAC name is methyl 3-[[(2R)-oxolan-2-yl]methyl-(pyridine-3-carbonyl)amino]propanoate.

Molecular Properties

Compound Name	Methyl 3-[[(2R)-oxolan-2-yl]methyl-(pyridine-3-carbonyl)amino]propanoate
PubChem CID	95480071
Molecular Formula	C₁₅H₂₀N₂O₄
Molecular Weight	292.33 g/mol
Exact Mass	292.14
IUPAC Name	methyl 3-[[(2R)-oxolan-2-yl]methyl-(pyridine-3-carbonyl)amino]propanoate
SMILES	COC(=O)CCN(C[C@H]1CCCO1)C(=O)c1cccnc1
InChI	InChI=1S/C15H20N2O4/c1-20-14(18)6-8-17(11-13-5-3-9-21-13)15(19)12-4-2-7-16-10-12/h2,4,7,10,13H,3,5-6,8-9,11H2,1H3/t13-/m1/s1
InChIKey	DEOWZZXUZDOEJY-CYBMUJFWSA-N
XLogP	1.27
TPSA	68.73 Å²
H-Bond Donors
H-Bond Acceptors	5
Rotatable Bonds	6
Heavy Atoms	21
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	292.33
LogP ≤ 5	1.27
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of Methyl 3-[[(2R)-oxolan-2-yl]methyl-(pyridine-3-carbonyl)amino]propanoate?

The IUPAC name of Methyl 3-[[(2R)-oxolan-2-yl]methyl-(pyridine-3-carbonyl)amino]propanoate (CID 95480071) is methyl 3-[[(2R)-oxolan-2-yl]methyl-(pyridine-3-carbonyl)amino]propanoate.

What is the SMILES notation for Methyl 3-[[(2R)-oxolan-2-yl]methyl-(pyridine-3-carbonyl)amino]propanoate?

The canonical SMILES for Methyl 3-[[(2R)-oxolan-2-yl]methyl-(pyridine-3-carbonyl)amino]propanoate is COC(=O)CCN(C[C@H]1CCCO1)C(=O)c1cccnc1.

What is the InChIKey of Methyl 3-[[(2R)-oxolan-2-yl]methyl-(pyridine-3-carbonyl)amino]propanoate?

The InChIKey is DEOWZZXUZDOEJY-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H20N2O4/c1-20-14(18)6-8-17(11-13-5-3-9-21-13)15(19)12-4-2-7-16-10-12/h2,4,7,10,13H,3,5-6,8-9,11H2,1H3/t13-/m1/s1.

What are the key properties of Methyl 3-[[(2R)-oxolan-2-yl]methyl-(pyridine-3-carbonyl)amino]propanoate?

Methyl 3-[[(2R)-oxolan-2-yl]methyl-(pyridine-3-carbonyl)amino]propanoate has a molecular weight of 292.33 g/mol, XLogP of 1.27, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for Methyl 3-[[(2R)-oxolan-2-yl]methyl-(pyridine-3-carbonyl)amino]propanoate is sourced from PubChem (CID 95480071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 95480071 — identifiers, structure, computed properties (public domain)

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