N-cyclopropyl-2-[[6-(propylaminomethyl)-3-pyridinyl]oxy]propanamide

C15H23N3O2 — CID 79782291

IUPACN-cyclopropyl-2-[[6-(propylaminomethyl)-3-pyridinyl]oxy]propanamide
SMILESCCCNCc1ccc(OC(C)C(=O)NC2CC2)cn1
InChIInChI=1S/C15H23N3O2/c1-3-8-16-9-13-6-7-14(10-17-13)20-11(2)15(19)18-12-4-5-12/h6-7,10-12,16H,3-5,8-9H2,1-2H3,(H,18,19)
InChIKeyXOAKAKHIMOBRBK-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.63
Rot. Bonds8

About N-cyclopropyl-2-[[6-(propylaminomethyl)-3-pyridinyl]oxy]propanamide

N-cyclopropyl-2-[[6-(propylaminomethyl)-3-pyridinyl]oxy]propanamide (PubChem CID 79782291) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-cyclopropyl-2-[[6-(propylaminomethyl)-3-pyridinyl]oxy]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[[6-(propylaminomethyl)-3-pyridinyl]oxy]propanamide
PubChem CID79782291
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-cyclopropyl-2-[[6-(propylaminomethyl)-3-pyridinyl]oxy]propanamide
SMILESCCCNCc1ccc(OC(C)C(=O)NC2CC2)cn1
InChIInChI=1S/C15H23N3O2/c1-3-8-16-9-13-6-7-14(10-17-13)20-11(2)15(19)18-12-4-5-12/h6-7,10-12,16H,3-5,8-9H2,1-2H3,(H,18,19)
InChIKeyXOAKAKHIMOBRBK-UHFFFAOYSA-N
XLogP1.63
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-propyl-2-[[6-(propylaminomethyl)-3-pyridinyl]oxy]propanamide
CID 79783974
2-[[6-[(tert-butylamino)methyl]-3-pyridinyl]oxy]-N-cyclopropylpropanamide
CID 79783476
N-cyclopropyl-2-[[6-(hydroxymethyl)-3-pyridinyl]oxy]propanamide
CID 79800191
N-cyclopropyl-2-[4-(propylaminomethyl)phenoxy]propanamide
CID 43276998
2-[[6-(2-aminobutyl)-3-pyridinyl]oxy]-N-cyclopropylpropanamide
CID 79795592
2-[[6-(propylaminomethyl)-3-pyridinyl]oxy]-1-pyrrolidin-1-ylpropan-1-one
CID 79781284
ethyl 2-[[6-[(cyclopropylamino)methyl]-3-pyridinyl]oxy]propanoate
CID 79783450
N-carbamoyl-2-[[6-[(cyclopropylamino)methyl]-3-pyridinyl]oxy]propanamide
CID 79781513
2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N-(ethylcarbamoyl)propanamide
CID 79782281
N-(cyclopropylmethyl)-2-[[6-(propylaminomethyl)-3-pyridinyl]oxy]acetamide
CID 79781850
N-cyclopropyl-2-(4-ethylphenoxy)propanamide
CID 60625156
2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]-N-pentan-3-ylpropanamide
CID 79775506

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[[6-(propylaminomethyl)-3-pyridinyl]oxy]propanamide?
The IUPAC name of N-cyclopropyl-2-[[6-(propylaminomethyl)-3-pyridinyl]oxy]propanamide (CID 79782291) is N-cyclopropyl-2-[[6-(propylaminomethyl)-3-pyridinyl]oxy]propanamide.
What is the SMILES notation for N-cyclopropyl-2-[[6-(propylaminomethyl)-3-pyridinyl]oxy]propanamide?
The canonical SMILES for N-cyclopropyl-2-[[6-(propylaminomethyl)-3-pyridinyl]oxy]propanamide is CCCNCc1ccc(OC(C)C(=O)NC2CC2)cn1.
What is the InChIKey of N-cyclopropyl-2-[[6-(propylaminomethyl)-3-pyridinyl]oxy]propanamide?
The InChIKey is XOAKAKHIMOBRBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-3-8-16-9-13-6-7-14(10-17-13)20-11(2)15(19)18-12-4-5-12/h6-7,10-12,16H,3-5,8-9H2,1-2H3,(H,18,19).
What are the key properties of N-cyclopropyl-2-[[6-(propylaminomethyl)-3-pyridinyl]oxy]propanamide?
N-cyclopropyl-2-[[6-(propylaminomethyl)-3-pyridinyl]oxy]propanamide has a molecular weight of 277.37 g/mol, XLogP of 1.63, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[[6-(propylaminomethyl)-3-pyridinyl]oxy]propanamide is sourced from PubChem (CID 79782291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).