potassium;hydride;2-[2-(4-methoxyphenoxy)ethoxy]acetaldehyde

C11H15KO4 — CID 173406321

IUPACpotassium;hydride;2-[2-(4-methoxyphenoxy)ethoxy]acetaldehyde
SMILESCOc1ccc(OCCOCC=O)cc1.[H-].[K+]
InChIInChI=1S/C11H14O4.K.H/c1-13-10-2-4-11(5-3-10)15-9-8-14-7-6-12;;/h2-6H,7-9H2,1H3;;/q;+1;-1
InChIKeyIXSGIUZHYQPRFI-UHFFFAOYSA-N
MW250.34 g/mol
LogP-1.59
Rot. Bonds7

About potassium;hydride;2-[2-(4-methoxyphenoxy)ethoxy]acetaldehyde

potassium;hydride;2-[2-(4-methoxyphenoxy)ethoxy]acetaldehyde (PubChem CID 173406321) has the molecular formula C11H15KO4 and a molecular weight of 250.34 g/mol. Its IUPAC name is potassium;hydride;2-[2-(4-methoxyphenoxy)ethoxy]acetaldehyde.

Molecular Properties

Compound Namepotassium;hydride;2-[2-(4-methoxyphenoxy)ethoxy]acetaldehyde
PubChem CID173406321
Molecular FormulaC11H15KO4
Molecular Weight250.34 g/mol
Exact Mass250.06
IUPAC Namepotassium;hydride;2-[2-(4-methoxyphenoxy)ethoxy]acetaldehyde
SMILESCOc1ccc(OCCOCC=O)cc1.[H-].[K+]
InChIInChI=1S/C11H14O4.K.H/c1-13-10-2-4-11(5-3-10)15-9-8-14-7-6-12;;/h2-6H,7-9H2,1H3;;/q;+1;-1
InChIKeyIXSGIUZHYQPRFI-UHFFFAOYSA-N
XLogP-1.59
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 5-1.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze potassium;hydride;2-[2-(4-methoxyphenoxy)ethoxy]acetaldehyde with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-methoxy-4-[2-(4-methylphenoxy)ethoxy]benzene
CID 2284217
5-(4-methoxyphenoxy)-3-methylpentanal
CID 90454943
N'-[2-[2-(4-methoxyphenoxy)ethoxy]ethyl]ethane-1,2-diamine
CID 2280947
1-[2-(2-hexoxyethoxy)ethoxy]-4-methoxybenzene
CID 58828240
1-(2-chloroethoxy)-4-methoxybenzene
CID 10081150
2-[2-[2-(2-oxoethoxy)ethoxy]ethoxy]acetaldehyde
CID 86256206
4-[2-[(4-methoxyphenyl)methoxy]ethoxy]aniline
CID 43174442
1-[(2R)-butan-2-yl]-4-[2-[2-(4-methoxyphenoxy)ethoxy]ethoxy]benzene
CID 2282958
N-[2-[2-(4-methoxyphenoxy)ethoxy]ethyl]propan-2-amine
CID 2280828
2-[2-(2-methoxyethoxy)ethoxy]acetaldehyde
CID 10607071
ethane;1-methoxy-4-(4-methoxybutoxy)benzene
CID 143283261
ethane;1-methoxy-4-(3-methoxypropoxy)benzene
CID 143283206

Frequently Asked Questions

What is the IUPAC name of potassium;hydride;2-[2-(4-methoxyphenoxy)ethoxy]acetaldehyde?
The IUPAC name of potassium;hydride;2-[2-(4-methoxyphenoxy)ethoxy]acetaldehyde (CID 173406321) is potassium;hydride;2-[2-(4-methoxyphenoxy)ethoxy]acetaldehyde.
What is the SMILES notation for potassium;hydride;2-[2-(4-methoxyphenoxy)ethoxy]acetaldehyde?
The canonical SMILES for potassium;hydride;2-[2-(4-methoxyphenoxy)ethoxy]acetaldehyde is COc1ccc(OCCOCC=O)cc1.[H-].[K+].
What is the InChIKey of potassium;hydride;2-[2-(4-methoxyphenoxy)ethoxy]acetaldehyde?
The InChIKey is IXSGIUZHYQPRFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O4.K.H/c1-13-10-2-4-11(5-3-10)15-9-8-14-7-6-12;;/h2-6H,7-9H2,1H3;;/q;+1;-1.
What are the key properties of potassium;hydride;2-[2-(4-methoxyphenoxy)ethoxy]acetaldehyde?
potassium;hydride;2-[2-(4-methoxyphenoxy)ethoxy]acetaldehyde has a molecular weight of 250.34 g/mol, XLogP of -1.59, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;hydride;2-[2-(4-methoxyphenoxy)ethoxy]acetaldehyde is sourced from PubChem (CID 173406321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).