N-ethoxy-3-pyridin-3-ylpropanamide

C10H14N2O2 — CID 60717875

IUPACN-ethoxy-3-pyridin-3-ylpropanamide
SMILESCCONC(=O)CCc1cccnc1
InChIInChI=1S/C10H14N2O2/c1-2-14-12-10(13)6-5-9-4-3-7-11-8-9/h3-4,7-8H,2,5-6H2,1H3,(H,12,13)
InChIKeyHSMKMFPIKHERDC-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.08
Rot. Bonds5

About N-ethoxy-3-pyridin-3-ylpropanamide

N-ethoxy-3-pyridin-3-ylpropanamide (PubChem CID 60717875) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is N-ethoxy-3-pyridin-3-ylpropanamide.

Molecular Properties

Compound NameN-ethoxy-3-pyridin-3-ylpropanamide
PubChem CID60717875
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC NameN-ethoxy-3-pyridin-3-ylpropanamide
SMILESCCONC(=O)CCc1cccnc1
InChIInChI=1S/C10H14N2O2/c1-2-14-12-10(13)6-5-9-4-3-7-11-8-9/h3-4,7-8H,2,5-6H2,1H3,(H,12,13)
InChIKeyHSMKMFPIKHERDC-UHFFFAOYSA-N
XLogP1.08
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

ethyl 3-pyridin-3-ylpropanoate;hydrazine;3-pyridin-3-ylpropanehydrazide
CID 159498879
ethyl 2-(3-pyridin-3-ylpropanoylamino)propanoate
CID 61344596
ethyl 4-(3-pyridin-3-ylpropanoylamino)piperidine-1-carboxylate
CID 31369357
(111C)methyl 3-pyridin-3-ylpropanoate
CID 11816043
N-(2-ethylbutyl)-3-pyridin-3-ylpropanamide
CID 115612776
ethyl 4-oxo-4-(2-pyridin-3-ylethylamino)butanoate
CID 60730072
N-(2-methylprop-1-enyl)-3-pyridin-3-ylpropanamide
CID 177435209
N-(5-ethyl-1H-pyrazol-3-yl)-3-pyridin-3-ylpropanamide
CID 47423313
1-amino-4-pyridin-3-ylbutan-2-one
CID 82414894
3-pyridin-3-ylpropanoic acid;hydrochloride
CID 66648902
N-prop-2-enyl-3-pyridin-3-ylpropanamide
CID 60667734
N-(1-amino-4-methylpentan-2-yl)-3-pyridin-3-ylpropanamide
CID 81486896

Frequently Asked Questions

What is the IUPAC name of N-ethoxy-3-pyridin-3-ylpropanamide?
The IUPAC name of N-ethoxy-3-pyridin-3-ylpropanamide (CID 60717875) is N-ethoxy-3-pyridin-3-ylpropanamide.
What is the SMILES notation for N-ethoxy-3-pyridin-3-ylpropanamide?
The canonical SMILES for N-ethoxy-3-pyridin-3-ylpropanamide is CCONC(=O)CCc1cccnc1.
What is the InChIKey of N-ethoxy-3-pyridin-3-ylpropanamide?
The InChIKey is HSMKMFPIKHERDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-2-14-12-10(13)6-5-9-4-3-7-11-8-9/h3-4,7-8H,2,5-6H2,1H3,(H,12,13).
What are the key properties of N-ethoxy-3-pyridin-3-ylpropanamide?
N-ethoxy-3-pyridin-3-ylpropanamide has a molecular weight of 194.23 g/mol, XLogP of 1.08, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethoxy-3-pyridin-3-ylpropanamide is sourced from PubChem (CID 60717875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).