2-quinolin-8-yloxybutanamide

C13H14N2O2 — CID 62901439

IUPAC2-quinolin-8-yloxybutanamide
SMILESCCC(Oc1cccc2cccnc12)C(N)=O
InChIInChI=1S/C13H14N2O2/c1-2-10(13(14)16)17-11-7-3-5-9-6-4-8-15-12(9)11/h3-8,10H,2H2,1H3,(H2,14,16)
InChIKeyWVIFPNAWGFNVLK-UHFFFAOYSA-N
MW230.27 g/mol
LogP1.88
Rot. Bonds4

About 2-quinolin-8-yloxybutanamide

2-quinolin-8-yloxybutanamide (PubChem CID 62901439) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is 2-quinolin-8-yloxybutanamide.

Molecular Properties

Compound Name2-quinolin-8-yloxybutanamide
PubChem CID62901439
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC Name2-quinolin-8-yloxybutanamide
SMILESCCC(Oc1cccc2cccnc12)C(N)=O
InChIInChI=1S/C13H14N2O2/c1-2-10(13(14)16)17-11-7-3-5-9-6-4-8-15-12(9)11/h3-8,10H,2H2,1H3,(H2,14,16)
InChIKeyWVIFPNAWGFNVLK-UHFFFAOYSA-N
XLogP1.88
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-quinolin-8-yloxybutanehydrazide
CID 63575214
8-[(2S)-butan-2-yl]oxyquinoline
CID 99646584
2-quinolin-8-yloxypentan-3-one
CID 64868229
quinolin-8-yl 2-ethylhexanoate
CID 163430049
2-amino-2-methyl-4-quinolin-8-yloxypentanamide
CID 64706156
2-(1-formylnaphthalen-2-yl)oxybutanamide
CID 62901202
8-[(2R)-1-methoxypropan-2-yl]oxyquinoline
CID 141434542
[(1-amino-2-quinolin-8-yloxyethylidene)amino] ethyl carbonate
CID 71320098
2-ethoxyethyl 2-quinolin-8-yloxyacetate
CID 71408852
4,4,4-trifluoro-3-quinolin-8-yloxybutanoic acid
CID 63073292
2-quinolin-8-yloxyacetate
CID 6950984
diquinolin-8-yl benzene-1,2-dicarboxylate
CID 154085915

Frequently Asked Questions

What is the IUPAC name of 2-quinolin-8-yloxybutanamide?
The IUPAC name of 2-quinolin-8-yloxybutanamide (CID 62901439) is 2-quinolin-8-yloxybutanamide.
What is the SMILES notation for 2-quinolin-8-yloxybutanamide?
The canonical SMILES for 2-quinolin-8-yloxybutanamide is CCC(Oc1cccc2cccnc12)C(N)=O.
What is the InChIKey of 2-quinolin-8-yloxybutanamide?
The InChIKey is WVIFPNAWGFNVLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c1-2-10(13(14)16)17-11-7-3-5-9-6-4-8-15-12(9)11/h3-8,10H,2H2,1H3,(H2,14,16).
What are the key properties of 2-quinolin-8-yloxybutanamide?
2-quinolin-8-yloxybutanamide has a molecular weight of 230.27 g/mol, XLogP of 1.88, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-quinolin-8-yloxybutanamide is sourced from PubChem (CID 62901439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).