3-(2-aminoethoxy)-N-(6-methoxy-3-pyridinyl)propanamide

C11H17N3O3 — CID 112738961

IUPAC3-(2-aminoethoxy)-N-(6-methoxy-3-pyridinyl)propanamide
SMILESCOc1ccc(NC(=O)CCOCCN)cn1
InChIInChI=1S/C11H17N3O3/c1-16-11-3-2-9(8-13-11)14-10(15)4-6-17-7-5-12/h2-3,8H,4-7,12H2,1H3,(H,14,15)
InChIKeyOFDSAPVXGWVJIQ-UHFFFAOYSA-N
MW239.28 g/mol
LogP0.39
Rot. Bonds7

About 3-(2-aminoethoxy)-N-(6-methoxy-3-pyridinyl)propanamide

3-(2-aminoethoxy)-N-(6-methoxy-3-pyridinyl)propanamide (PubChem CID 112738961) has the molecular formula C11H17N3O3 and a molecular weight of 239.28 g/mol. Its IUPAC name is 3-(2-aminoethoxy)-N-(6-methoxy-3-pyridinyl)propanamide.

Molecular Properties

Compound Name3-(2-aminoethoxy)-N-(6-methoxy-3-pyridinyl)propanamide
PubChem CID112738961
Molecular FormulaC11H17N3O3
Molecular Weight239.28 g/mol
Exact Mass239.13
IUPAC Name3-(2-aminoethoxy)-N-(6-methoxy-3-pyridinyl)propanamide
SMILESCOc1ccc(NC(=O)CCOCCN)cn1
InChIInChI=1S/C11H17N3O3/c1-16-11-3-2-9(8-13-11)14-10(15)4-6-17-7-5-12/h2-3,8H,4-7,12H2,1H3,(H,14,15)
InChIKeyOFDSAPVXGWVJIQ-UHFFFAOYSA-N
XLogP0.39
TPSA86.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 50.39
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

3-(4-tert-butylphenoxy)-N-(6-methoxy-3-pyridinyl)propanamide
CID 18289170
2-chloro-N-(6-methoxy-3-pyridinyl)acetamide
CID 2561820
3-acetamido-N-(6-methoxy-3-pyridinyl)propanamide
CID 47096905
6-amino-N-[6-(2-methoxyethoxy)-3-pyridinyl]hexanamide
CID 43704143
(3Z)-3-amino-3-hydroxyimino-N-(6-methoxy-3-pyridinyl)propanamide
CID 43156078
3-(2,5-dimethylpyrrol-1-yl)-N-(6-methoxy-3-pyridinyl)propanamide
CID 110204854
N-(6-methoxy-3-pyridinyl)-4-phenylbutanamide
CID 52615794
2-(2-aminophenyl)-N-(6-methoxy-3-pyridinyl)acetamide
CID 16795634
4-amino-N-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]benzamide
CID 43822670
N-(6-amino-3-pyridinyl)-3-ethoxypropanamide;hydrochloride
CID 119515208
2-(2-methoxyphenoxy)-N-(6-methoxy-3-pyridinyl)acetamide
CID 2677021
1-(aminomethyl)-N-(6-methoxy-3-pyridinyl)cyclopentane-1-carboxamide
CID 55037854

Frequently Asked Questions

What is the IUPAC name of 3-(2-aminoethoxy)-N-(6-methoxy-3-pyridinyl)propanamide?
The IUPAC name of 3-(2-aminoethoxy)-N-(6-methoxy-3-pyridinyl)propanamide (CID 112738961) is 3-(2-aminoethoxy)-N-(6-methoxy-3-pyridinyl)propanamide.
What is the SMILES notation for 3-(2-aminoethoxy)-N-(6-methoxy-3-pyridinyl)propanamide?
The canonical SMILES for 3-(2-aminoethoxy)-N-(6-methoxy-3-pyridinyl)propanamide is COc1ccc(NC(=O)CCOCCN)cn1.
What is the InChIKey of 3-(2-aminoethoxy)-N-(6-methoxy-3-pyridinyl)propanamide?
The InChIKey is OFDSAPVXGWVJIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3/c1-16-11-3-2-9(8-13-11)14-10(15)4-6-17-7-5-12/h2-3,8H,4-7,12H2,1H3,(H,14,15).
What are the key properties of 3-(2-aminoethoxy)-N-(6-methoxy-3-pyridinyl)propanamide?
3-(2-aminoethoxy)-N-(6-methoxy-3-pyridinyl)propanamide has a molecular weight of 239.28 g/mol, XLogP of 0.39, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminoethoxy)-N-(6-methoxy-3-pyridinyl)propanamide is sourced from PubChem (CID 112738961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).