2-(2-morpholin-4-ylethylamino)-N-(pyridin-3-ylmethyl)acetamide

C14H22N4O2 — CID 108994762

IUPAC2-(2-morpholin-4-ylethylamino)-N-(pyridin-3-ylmethyl)acetamide
SMILESO=C(CNCCN1CCOCC1)NCc1cccnc1
InChIInChI=1S/C14H22N4O2/c19-14(17-11-13-2-1-3-15-10-13)12-16-4-5-18-6-8-20-9-7-18/h1-3,10,16H,4-9,11-12H2,(H,17,19)
InChIKeyASTSSPJEGCKQHU-UHFFFAOYSA-N
MW278.36 g/mol
LogP-0.38
Rot. Bonds7

About 2-(2-morpholin-4-ylethylamino)-N-(pyridin-3-ylmethyl)acetamide

2-(2-morpholin-4-ylethylamino)-N-(pyridin-3-ylmethyl)acetamide (PubChem CID 108994762) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is 2-(2-morpholin-4-ylethylamino)-N-(pyridin-3-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(2-morpholin-4-ylethylamino)-N-(pyridin-3-ylmethyl)acetamide
PubChem CID108994762
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC Name2-(2-morpholin-4-ylethylamino)-N-(pyridin-3-ylmethyl)acetamide
SMILESO=C(CNCCN1CCOCC1)NCc1cccnc1
InChIInChI=1S/C14H22N4O2/c19-14(17-11-13-2-1-3-15-10-13)12-16-4-5-18-6-8-20-9-7-18/h1-3,10,16H,4-9,11-12H2,(H,17,19)
InChIKeyASTSSPJEGCKQHU-UHFFFAOYSA-N
XLogP-0.38
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 5-0.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(1,4-oxazepan-4-yl)-N-(pyridin-3-ylmethyl)ethanamine
CID 62968313
1-(3-morpholin-4-ylpropyl)-3-(pyridin-3-ylmethyl)urea
CID 127566290
N-[(3-methylphenyl)methyl]-2-(2-morpholin-4-ylethylamino)acetamide
CID 108994751
3-morpholin-4-yl-3-oxo-N-(pyridin-3-ylmethyl)propanamide
CID 108943446
2-methyl-1-(2-morpholin-4-ylethyl)-3-(pyridin-3-ylmethyl)guanidine
CID 111023394
5-(2-morpholin-4-ylethylamino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
CID 109185798
(Z)-2-cyano-3-(2-morpholin-4-ylethylamino)-N-(pyridin-3-ylmethyl)prop-2-enamide
CID 108837388
2-(2-morpholin-4-ylethylamino)-N-(pyridin-3-ylmethyl)pyridine-4-carboxamide
CID 109168044
N-(2-morpholin-4-ylethyl)-5-(pyridin-3-ylmethylamino)pyrazine-2-carboxamide
CID 109277480
(Z)-2-cyano-N-(2-morpholin-4-ylethyl)-3-(pyridin-3-ylmethylamino)prop-2-enamide
CID 108862942
7-methoxy-1-(2-morpholin-4-ylethyl)-N-(pyridin-3-ylmethyl)indazole-3-carboxamide
CID 18765507
N-(2-morpholin-4-ylethyl)-6-(pyridin-3-ylmethylamino)pyrimidine-4-carboxamide
CID 109344568

Frequently Asked Questions

What is the IUPAC name of 2-(2-morpholin-4-ylethylamino)-N-(pyridin-3-ylmethyl)acetamide?
The IUPAC name of 2-(2-morpholin-4-ylethylamino)-N-(pyridin-3-ylmethyl)acetamide (CID 108994762) is 2-(2-morpholin-4-ylethylamino)-N-(pyridin-3-ylmethyl)acetamide.
What is the SMILES notation for 2-(2-morpholin-4-ylethylamino)-N-(pyridin-3-ylmethyl)acetamide?
The canonical SMILES for 2-(2-morpholin-4-ylethylamino)-N-(pyridin-3-ylmethyl)acetamide is O=C(CNCCN1CCOCC1)NCc1cccnc1.
What is the InChIKey of 2-(2-morpholin-4-ylethylamino)-N-(pyridin-3-ylmethyl)acetamide?
The InChIKey is ASTSSPJEGCKQHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c19-14(17-11-13-2-1-3-15-10-13)12-16-4-5-18-6-8-20-9-7-18/h1-3,10,16H,4-9,11-12H2,(H,17,19).
What are the key properties of 2-(2-morpholin-4-ylethylamino)-N-(pyridin-3-ylmethyl)acetamide?
2-(2-morpholin-4-ylethylamino)-N-(pyridin-3-ylmethyl)acetamide has a molecular weight of 278.36 g/mol, XLogP of -0.38, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-morpholin-4-ylethylamino)-N-(pyridin-3-ylmethyl)acetamide is sourced from PubChem (CID 108994762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).