5-[5-fluoro-2-(2-morpholin-4-ylethoxy)phenyl]furan-2-carbaldehyde

C17H18FNO4 — CID 169334696

IUPAC5-[5-fluoro-2-(2-morpholin-4-ylethoxy)phenyl]furan-2-carbaldehyde
SMILESO=Cc1ccc(-c2cc(F)ccc2OCCN2CCOCC2)o1
InChIInChI=1S/C17H18FNO4/c18-13-1-3-16(22-10-7-19-5-8-21-9-6-19)15(11-13)17-4-2-14(12-20)23-17/h1-4,11-12H,5-10H2
InChIKeyKYUPVVGIQCWLPX-UHFFFAOYSA-N
MW319.33 g/mol
LogP2.61
Rot. Bonds6

About 5-[5-fluoro-2-(2-morpholin-4-ylethoxy)phenyl]furan-2-carbaldehyde

5-[5-fluoro-2-(2-morpholin-4-ylethoxy)phenyl]furan-2-carbaldehyde (PubChem CID 169334696) has the molecular formula C17H18FNO4 and a molecular weight of 319.33 g/mol. Its IUPAC name is 5-[5-fluoro-2-(2-morpholin-4-ylethoxy)phenyl]furan-2-carbaldehyde.

Molecular Properties

Compound Name5-[5-fluoro-2-(2-morpholin-4-ylethoxy)phenyl]furan-2-carbaldehyde
PubChem CID169334696
Molecular FormulaC17H18FNO4
Molecular Weight319.33 g/mol
Exact Mass319.12
IUPAC Name5-[5-fluoro-2-(2-morpholin-4-ylethoxy)phenyl]furan-2-carbaldehyde
SMILESO=Cc1ccc(-c2cc(F)ccc2OCCN2CCOCC2)o1
InChIInChI=1S/C17H18FNO4/c18-13-1-3-16(22-10-7-19-5-8-21-9-6-19)15(11-13)17-4-2-14(12-20)23-17/h1-4,11-12H,5-10H2
InChIKeyKYUPVVGIQCWLPX-UHFFFAOYSA-N
XLogP2.61
TPSA51.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.33
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

4-methoxy-3-(2-morpholin-4-ylethoxy)benzaldehyde
CID 3251033
3-fluoro-4-(2-morpholin-4-ylethoxy)benzoic acid
CID 107689816
4-(2-morpholin-4-ylethoxy)-3-nitrobenzaldehyde
CID 23117913
1-[5-fluoro-2-(2-morpholin-4-ylethoxy)phenyl]butan-2-amine
CID 107701557
4-[2-(2,3-difluoro-4-methylphenoxy)ethyl]morpholine
CID 123286014
N-[1-[4-fluoro-2-(2-morpholin-4-ylethoxy)phenyl]ethylidene]hydroxylamine
CID 76983457
3-fluoro-4-(2-morpholin-4-ylethoxy)benzamide
CID 22318780
4-(2-morpholin-4-ylethoxy)benzaldehyde;hydrochloride
CID 23117912
4-[2-[4-(2,4-difluorophenyl)-3-methylphenoxy]ethyl]morpholine
CID 173296855
3-methyl-2-(2-morpholin-4-ylethoxy)-4-propoxybenzaldehyde
CID 71420401
2,4-difluoro-N-[3-(2-methylpyrazol-3-yl)-4-(2-morpholin-4-ylethoxy)phenyl]benzamide
CID 46833073
5-(2-bromo-3,5-difluorophenyl)furan-2-carbaldehyde
CID 169332004

Frequently Asked Questions

What is the IUPAC name of 5-[5-fluoro-2-(2-morpholin-4-ylethoxy)phenyl]furan-2-carbaldehyde?
The IUPAC name of 5-[5-fluoro-2-(2-morpholin-4-ylethoxy)phenyl]furan-2-carbaldehyde (CID 169334696) is 5-[5-fluoro-2-(2-morpholin-4-ylethoxy)phenyl]furan-2-carbaldehyde.
What is the SMILES notation for 5-[5-fluoro-2-(2-morpholin-4-ylethoxy)phenyl]furan-2-carbaldehyde?
The canonical SMILES for 5-[5-fluoro-2-(2-morpholin-4-ylethoxy)phenyl]furan-2-carbaldehyde is O=Cc1ccc(-c2cc(F)ccc2OCCN2CCOCC2)o1.
What is the InChIKey of 5-[5-fluoro-2-(2-morpholin-4-ylethoxy)phenyl]furan-2-carbaldehyde?
The InChIKey is KYUPVVGIQCWLPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO4/c18-13-1-3-16(22-10-7-19-5-8-21-9-6-19)15(11-13)17-4-2-14(12-20)23-17/h1-4,11-12H,5-10H2.
What are the key properties of 5-[5-fluoro-2-(2-morpholin-4-ylethoxy)phenyl]furan-2-carbaldehyde?
5-[5-fluoro-2-(2-morpholin-4-ylethoxy)phenyl]furan-2-carbaldehyde has a molecular weight of 319.33 g/mol, XLogP of 2.61, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[5-fluoro-2-(2-morpholin-4-ylethoxy)phenyl]furan-2-carbaldehyde is sourced from PubChem (CID 169334696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).