2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]-N-pentan-3-ylpropanamide

C15H25N3O2 — CID 79775506

IUPAC2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]-N-pentan-3-ylpropanamide
SMILESCCC(CC)NC(=O)C(C)Oc1ccc(CNC)nc1
InChIInChI=1S/C15H25N3O2/c1-5-12(6-2)18-15(19)11(3)20-14-8-7-13(9-16-4)17-10-14/h7-8,10-12,16H,5-6,9H2,1-4H3,(H,18,19)
InChIKeyUEXUKNFXPAYPCM-UHFFFAOYSA-N
MW279.38 g/mol
LogP1.87
Rot. Bonds8

About 2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]-N-pentan-3-ylpropanamide

2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]-N-pentan-3-ylpropanamide (PubChem CID 79775506) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is 2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]-N-pentan-3-ylpropanamide.

Molecular Properties

Compound Name2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]-N-pentan-3-ylpropanamide
PubChem CID79775506
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC Name2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]-N-pentan-3-ylpropanamide
SMILESCCC(CC)NC(=O)C(C)Oc1ccc(CNC)nc1
InChIInChI=1S/C15H25N3O2/c1-5-12(6-2)18-15(19)11(3)20-14-8-7-13(9-16-4)17-10-14/h7-8,10-12,16H,5-6,9H2,1-4H3,(H,18,19)
InChIKeyUEXUKNFXPAYPCM-UHFFFAOYSA-N
XLogP1.87
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]propanoic acid
CID 79776211
5-[1-oxo-1-(pentan-3-ylamino)propan-2-yl]oxypyridine-2-carboxylic acid
CID 79794170
2-[4-[(1R)-1-hydroxyethyl]phenoxy]-N-pentan-3-ylpropanamide
CID 63364137
N-propyl-2-[[6-(propylaminomethyl)-3-pyridinyl]oxy]propanamide
CID 79783974
2-[4-[(1S)-1-aminopropyl]phenoxy]-N-pentan-3-ylpropanamide
CID 63367662
2-[[6-(hydroxymethyl)-3-pyridinyl]oxy]-N-methylpropanamide
CID 79799827
4-[1-oxo-1-(pentan-3-ylamino)propan-2-yl]oxybenzoic acid
CID 43113684
2-(4-fluorophenoxy)-N-pentan-3-ylpropanamide
CID 53282042
2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N-(ethylcarbamoyl)propanamide
CID 79782281
2-[4-(2-hydroxypropyl)phenoxy]-N-pentan-3-ylpropanamide
CID 115495748
2-[[6-(hydroxymethyl)-3-pyridinyl]oxy]-N-(methylcarbamoyl)propanamide
CID 79799543
N-cyclopropyl-2-[[6-(propylaminomethyl)-3-pyridinyl]oxy]propanamide
CID 79782291

Frequently Asked Questions

What is the IUPAC name of 2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]-N-pentan-3-ylpropanamide?
The IUPAC name of 2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]-N-pentan-3-ylpropanamide (CID 79775506) is 2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]-N-pentan-3-ylpropanamide.
What is the SMILES notation for 2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]-N-pentan-3-ylpropanamide?
The canonical SMILES for 2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]-N-pentan-3-ylpropanamide is CCC(CC)NC(=O)C(C)Oc1ccc(CNC)nc1.
What is the InChIKey of 2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]-N-pentan-3-ylpropanamide?
The InChIKey is UEXUKNFXPAYPCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-5-12(6-2)18-15(19)11(3)20-14-8-7-13(9-16-4)17-10-14/h7-8,10-12,16H,5-6,9H2,1-4H3,(H,18,19).
What are the key properties of 2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]-N-pentan-3-ylpropanamide?
2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]-N-pentan-3-ylpropanamide has a molecular weight of 279.38 g/mol, XLogP of 1.87, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]-N-pentan-3-ylpropanamide is sourced from PubChem (CID 79775506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).