5-amino-1-[3-[3-(2-methoxyethoxy)propoxy]propyl]pyridin-2-one

C14H24N2O4 — CID 103401156

IUPAC5-amino-1-[3-[3-(2-methoxyethoxy)propoxy]propyl]pyridin-2-one
SMILESCOCCOCCCOCCCn1cc(N)ccc1=O
InChIInChI=1S/C14H24N2O4/c1-18-10-11-20-9-3-8-19-7-2-6-16-12-13(15)4-5-14(16)17/h4-5,12H,2-3,6-11,15H2,1H3
InChIKeyGRHHRFFSWYASPA-UHFFFAOYSA-N
MW284.36 g/mol
LogP0.89
Rot. Bonds11

About 5-amino-1-[3-[3-(2-methoxyethoxy)propoxy]propyl]pyridin-2-one

5-amino-1-[3-[3-(2-methoxyethoxy)propoxy]propyl]pyridin-2-one (PubChem CID 103401156) has the molecular formula C14H24N2O4 and a molecular weight of 284.36 g/mol. Its IUPAC name is 5-amino-1-[3-[3-(2-methoxyethoxy)propoxy]propyl]pyridin-2-one.

Molecular Properties

Compound Name5-amino-1-[3-[3-(2-methoxyethoxy)propoxy]propyl]pyridin-2-one
PubChem CID103401156
Molecular FormulaC14H24N2O4
Molecular Weight284.36 g/mol
Exact Mass284.17
IUPAC Name5-amino-1-[3-[3-(2-methoxyethoxy)propoxy]propyl]pyridin-2-one
SMILESCOCCOCCCOCCCn1cc(N)ccc1=O
InChIInChI=1S/C14H24N2O4/c1-18-10-11-20-9-3-8-19-7-2-6-16-12-13(15)4-5-14(16)17/h4-5,12H,2-3,6-11,15H2,1H3
InChIKeyGRHHRFFSWYASPA-UHFFFAOYSA-N
XLogP0.89
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

5-amino-1-[2-(2-butoxyethoxy)ethyl]pyridin-2-one
CID 43260157
5-amino-1-[3-(2-methoxyethylsulfanyl)propyl]pyridin-2-one
CID 43446011
5-amino-1-[3-(2-cyclopropylethoxy)propyl]pyridin-2-one
CID 106199955
1-[4-(2-methoxyethoxy)butyl]-6-oxopyridine-3-carboxylic acid
CID 113464125
5-amino-1-[2-(2-methoxyethylsulfanyl)ethyl]pyridin-2-one
CID 43446012
5-amino-1-(3-aminopropyl)pyridin-2-one
CID 82503026
5-amino-1-(5-hydroxypentyl)pyridin-2-one
CID 62228479
5-amino-1-[3-(dimethylamino)propyl]pyridin-2-one
CID 43259607
5-amino-1-[3-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)propyl]pyridin-2-one
CID 102721710
5-bromo-1-(4-methoxybutyl)pyridin-2-one
CID 115735573
methoxymethyl 2-(5-amino-2-oxo-1-pyridinyl)acetate
CID 65364298
5-amino-1-[3-(4-bromo-3-methylphenoxy)propyl]pyridin-2-one
CID 83133851

Frequently Asked Questions

What is the IUPAC name of 5-amino-1-[3-[3-(2-methoxyethoxy)propoxy]propyl]pyridin-2-one?
The IUPAC name of 5-amino-1-[3-[3-(2-methoxyethoxy)propoxy]propyl]pyridin-2-one (CID 103401156) is 5-amino-1-[3-[3-(2-methoxyethoxy)propoxy]propyl]pyridin-2-one.
What is the SMILES notation for 5-amino-1-[3-[3-(2-methoxyethoxy)propoxy]propyl]pyridin-2-one?
The canonical SMILES for 5-amino-1-[3-[3-(2-methoxyethoxy)propoxy]propyl]pyridin-2-one is COCCOCCCOCCCn1cc(N)ccc1=O.
What is the InChIKey of 5-amino-1-[3-[3-(2-methoxyethoxy)propoxy]propyl]pyridin-2-one?
The InChIKey is GRHHRFFSWYASPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O4/c1-18-10-11-20-9-3-8-19-7-2-6-16-12-13(15)4-5-14(16)17/h4-5,12H,2-3,6-11,15H2,1H3.
What are the key properties of 5-amino-1-[3-[3-(2-methoxyethoxy)propoxy]propyl]pyridin-2-one?
5-amino-1-[3-[3-(2-methoxyethoxy)propoxy]propyl]pyridin-2-one has a molecular weight of 284.36 g/mol, XLogP of 0.89, 11 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-[3-[3-(2-methoxyethoxy)propoxy]propyl]pyridin-2-one is sourced from PubChem (CID 103401156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).