N-[[2-(4-ethoxyphenoxy)-4-pyridinyl]methyl]morpholine-2-carboxamide

C19H23N3O4 — CID 119847525

IUPACN-[[2-(4-ethoxyphenoxy)-4-pyridinyl]methyl]morpholine-2-carboxamide
SMILESCCOc1ccc(Oc2cc(CNC(=O)C3CNCCO3)ccn2)cc1
InChIInChI=1S/C19H23N3O4/c1-2-24-15-3-5-16(6-4-15)26-18-11-14(7-8-21-18)12-22-19(23)17-13-20-9-10-25-17/h3-8,11,17,20H,2,9-10,12-13H2,1H3,(H,22,23)
InChIKeyODBFUKDVBYRXSM-UHFFFAOYSA-N
MW357.41 g/mol
LogP1.88
Rot. Bonds7

About N-[[2-(4-ethoxyphenoxy)-4-pyridinyl]methyl]morpholine-2-carboxamide

N-[[2-(4-ethoxyphenoxy)-4-pyridinyl]methyl]morpholine-2-carboxamide (PubChem CID 119847525) has the molecular formula C19H23N3O4 and a molecular weight of 357.41 g/mol. Its IUPAC name is N-[[2-(4-ethoxyphenoxy)-4-pyridinyl]methyl]morpholine-2-carboxamide.

Molecular Properties

Compound NameN-[[2-(4-ethoxyphenoxy)-4-pyridinyl]methyl]morpholine-2-carboxamide
PubChem CID119847525
Molecular FormulaC19H23N3O4
Molecular Weight357.41 g/mol
Exact Mass357.17
IUPAC NameN-[[2-(4-ethoxyphenoxy)-4-pyridinyl]methyl]morpholine-2-carboxamide
SMILESCCOc1ccc(Oc2cc(CNC(=O)C3CNCCO3)ccn2)cc1
InChIInChI=1S/C19H23N3O4/c1-2-24-15-3-5-16(6-4-15)26-18-11-14(7-8-21-18)12-22-19(23)17-13-20-9-10-25-17/h3-8,11,17,20H,2,9-10,12-13H2,1H3,(H,22,23)
InChIKeyODBFUKDVBYRXSM-UHFFFAOYSA-N
XLogP1.88
TPSA81.71 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(4-propoxyphenyl)methyl]morpholine-2-carboxamide
CID 119714378
(2S,5R)-5-(aminomethyl)-N-[[2-(4-ethoxyphenoxy)-4-pyridinyl]methyl]oxolane-2-carboxamide;dihydrochloride
CID 120797985
4-amino-N-[[2-(4-ethoxyphenoxy)-4-pyridinyl]methyl]butanamide
CID 119847529
(4-ethoxyphenyl)-morpholin-2-ylmethanone
CID 116561587
N-[[4-(4-fluorophenoxy)-3-methylphenyl]methyl]morpholine-2-carboxamide
CID 119758431
N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]morpholine-2-carboxamide;dihydrochloride
CID 119846941
2-cyclohexyl-N-[[2-(4-ethoxyphenoxy)-4-pyridinyl]methyl]acetamide
CID 55887691
N-[[2-(4-ethoxyphenoxy)-4-pyridinyl]methyl]-2-(methylamino)acetamide;hydrochloride
CID 120703944
N-[[4-(ethoxymethyl)phenyl]methyl]morpholine-2-carboxamide;hydrochloride
CID 119718295
N-[[2-(4-ethoxyphenoxy)-4-pyridinyl]methyl]-2-naphthalen-1-ylacetamide
CID 55888076
N-[[2-(4-ethoxyphenoxy)-4-pyridinyl]methyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 47063430
N-[[2-(4-ethoxyphenoxy)-4-pyridinyl]methyl]-2-thiomorpholin-3-ylacetamide
CID 119941150

Frequently Asked Questions

What is the IUPAC name of N-[[2-(4-ethoxyphenoxy)-4-pyridinyl]methyl]morpholine-2-carboxamide?
The IUPAC name of N-[[2-(4-ethoxyphenoxy)-4-pyridinyl]methyl]morpholine-2-carboxamide (CID 119847525) is N-[[2-(4-ethoxyphenoxy)-4-pyridinyl]methyl]morpholine-2-carboxamide.
What is the SMILES notation for N-[[2-(4-ethoxyphenoxy)-4-pyridinyl]methyl]morpholine-2-carboxamide?
The canonical SMILES for N-[[2-(4-ethoxyphenoxy)-4-pyridinyl]methyl]morpholine-2-carboxamide is CCOc1ccc(Oc2cc(CNC(=O)C3CNCCO3)ccn2)cc1.
What is the InChIKey of N-[[2-(4-ethoxyphenoxy)-4-pyridinyl]methyl]morpholine-2-carboxamide?
The InChIKey is ODBFUKDVBYRXSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O4/c1-2-24-15-3-5-16(6-4-15)26-18-11-14(7-8-21-18)12-22-19(23)17-13-20-9-10-25-17/h3-8,11,17,20H,2,9-10,12-13H2,1H3,(H,22,23).
What are the key properties of N-[[2-(4-ethoxyphenoxy)-4-pyridinyl]methyl]morpholine-2-carboxamide?
N-[[2-(4-ethoxyphenoxy)-4-pyridinyl]methyl]morpholine-2-carboxamide has a molecular weight of 357.41 g/mol, XLogP of 1.88, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(4-ethoxyphenoxy)-4-pyridinyl]methyl]morpholine-2-carboxamide is sourced from PubChem (CID 119847525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).