2-[4-(6-ethoxypyridine-3-carbonyl)morpholin-2-yl]acetic acid

C14H18N2O5 — CID 119248952

IUPAC2-[4-(6-ethoxypyridine-3-carbonyl)morpholin-2-yl]acetic acid
SMILESCCOc1ccc(C(=O)N2CCOC(CC(=O)O)C2)cn1
InChIInChI=1S/C14H18N2O5/c1-2-20-12-4-3-10(8-15-12)14(19)16-5-6-21-11(9-16)7-13(17)18/h3-4,8,11H,2,5-7,9H2,1H3,(H,17,18)
InChIKeyTZESXGLXENXFLO-UHFFFAOYSA-N
MW294.31 g/mol
LogP0.80
Rot. Bonds5

About 2-[4-(6-ethoxypyridine-3-carbonyl)morpholin-2-yl]acetic acid

2-[4-(6-ethoxypyridine-3-carbonyl)morpholin-2-yl]acetic acid (PubChem CID 119248952) has the molecular formula C14H18N2O5 and a molecular weight of 294.31 g/mol. Its IUPAC name is 2-[4-(6-ethoxypyridine-3-carbonyl)morpholin-2-yl]acetic acid.

Molecular Properties

Compound Name2-[4-(6-ethoxypyridine-3-carbonyl)morpholin-2-yl]acetic acid
PubChem CID119248952
Molecular FormulaC14H18N2O5
Molecular Weight294.31 g/mol
Exact Mass294.12
IUPAC Name2-[4-(6-ethoxypyridine-3-carbonyl)morpholin-2-yl]acetic acid
SMILESCCOc1ccc(C(=O)N2CCOC(CC(=O)O)C2)cn1
InChIInChI=1S/C14H18N2O5/c1-2-20-12-4-3-10(8-15-12)14(19)16-5-6-21-11(9-16)7-13(17)18/h3-4,8,11H,2,5-7,9H2,1H3,(H,17,18)
InChIKeyTZESXGLXENXFLO-UHFFFAOYSA-N
XLogP0.80
TPSA88.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.31
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-(6-chloropyridine-3-carbonyl)morpholin-2-yl]acetic acid
CID 66420959
2-[4-(3-ethoxybenzoyl)morpholin-2-yl]acetic acid
CID 119248791
2-[4-(3,4-dimethylbenzoyl)morpholin-2-yl]acetic acid
CID 66433602
2-[4-(1-ethylpyrazole-4-carbonyl)morpholin-2-yl]acetic acid
CID 119248465
2-[(2S)-4-(1-tert-butylpyrazole-4-carbonyl)morpholin-2-yl]acetic acid
CID 124682528
2-[(2R)-4-(1-tert-butylpyrazole-4-carbonyl)morpholin-2-yl]acetic acid
CID 124682530
2-[4-(6-ethoxypyrazin-2-yl)morpholin-2-yl]acetic acid
CID 66435962
2-[4-(3-fluoro-4-methylbenzoyl)morpholin-2-yl]acetic acid
CID 66421551
2-[4-(3-iodo-4-methylbenzoyl)morpholin-2-yl]acetic acid
CID 119247963
2-[4-(2-ethoxy-3-fluorobenzoyl)morpholin-2-yl]acetic acid
CID 119247688
2-[(2S)-4-(4-bromo-3,5-dimethoxybenzoyl)morpholin-2-yl]acetic acid
CID 129465784
6-ethoxy-N-[(4-methylmorpholin-2-yl)methyl]pyridine-3-carboxamide
CID 49093596

Frequently Asked Questions

What is the IUPAC name of 2-[4-(6-ethoxypyridine-3-carbonyl)morpholin-2-yl]acetic acid?
The IUPAC name of 2-[4-(6-ethoxypyridine-3-carbonyl)morpholin-2-yl]acetic acid (CID 119248952) is 2-[4-(6-ethoxypyridine-3-carbonyl)morpholin-2-yl]acetic acid.
What is the SMILES notation for 2-[4-(6-ethoxypyridine-3-carbonyl)morpholin-2-yl]acetic acid?
The canonical SMILES for 2-[4-(6-ethoxypyridine-3-carbonyl)morpholin-2-yl]acetic acid is CCOc1ccc(C(=O)N2CCOC(CC(=O)O)C2)cn1.
What is the InChIKey of 2-[4-(6-ethoxypyridine-3-carbonyl)morpholin-2-yl]acetic acid?
The InChIKey is TZESXGLXENXFLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O5/c1-2-20-12-4-3-10(8-15-12)14(19)16-5-6-21-11(9-16)7-13(17)18/h3-4,8,11H,2,5-7,9H2,1H3,(H,17,18).
What are the key properties of 2-[4-(6-ethoxypyridine-3-carbonyl)morpholin-2-yl]acetic acid?
2-[4-(6-ethoxypyridine-3-carbonyl)morpholin-2-yl]acetic acid has a molecular weight of 294.31 g/mol, XLogP of 0.80, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(6-ethoxypyridine-3-carbonyl)morpholin-2-yl]acetic acid is sourced from PubChem (CID 119248952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).