2-(2-ethoxyethoxy)ethanol;piperidine;thiophene

C15H29NO3S — CID 157368980

IUPAC2-(2-ethoxyethoxy)ethanol;piperidine;thiophene
SMILESC1CCNCC1.CCOCCOCCO.c1ccsc1
InChIInChI=1S/C6H14O3.C5H11N.C4H4S/c1-2-8-5-6-9-4-3-7;1-2-4-6-5-3-1;1-2-4-5-3-1/h7H,2-6H2,1H3;6H,1-5H2;1-4H
InChIKeyBJNIIGYXCSPERL-UHFFFAOYSA-N
MW303.47 g/mol
LogP2.54
Rot. Bonds6

About 2-(2-ethoxyethoxy)ethanol;piperidine;thiophene

2-(2-ethoxyethoxy)ethanol;piperidine;thiophene (PubChem CID 157368980) has the molecular formula C15H29NO3S and a molecular weight of 303.47 g/mol. Its IUPAC name is 2-(2-ethoxyethoxy)ethanol;piperidine;thiophene.

Molecular Properties

Compound Name2-(2-ethoxyethoxy)ethanol;piperidine;thiophene
PubChem CID157368980
Molecular FormulaC15H29NO3S
Molecular Weight303.47 g/mol
Exact Mass303.19
IUPAC Name2-(2-ethoxyethoxy)ethanol;piperidine;thiophene
SMILESC1CCNCC1.CCOCCOCCO.c1ccsc1
InChIInChI=1S/C6H14O3.C5H11N.C4H4S/c1-2-8-5-6-9-4-3-7;1-2-4-6-5-3-1;1-2-4-5-3-1/h7H,2-6H2,1H3;6H,1-5H2;1-4H
InChIKeyBJNIIGYXCSPERL-UHFFFAOYSA-N
XLogP2.54
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.47
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-(2-ethoxyethoxy)ethanol;piperidine;thiophene with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxyethoxy)ethanol;piperidine;thiophene?
The IUPAC name of 2-(2-ethoxyethoxy)ethanol;piperidine;thiophene (CID 157368980) is 2-(2-ethoxyethoxy)ethanol;piperidine;thiophene.
What is the SMILES notation for 2-(2-ethoxyethoxy)ethanol;piperidine;thiophene?
The canonical SMILES for 2-(2-ethoxyethoxy)ethanol;piperidine;thiophene is C1CCNCC1.CCOCCOCCO.c1ccsc1.
What is the InChIKey of 2-(2-ethoxyethoxy)ethanol;piperidine;thiophene?
The InChIKey is BJNIIGYXCSPERL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14O3.C5H11N.C4H4S/c1-2-8-5-6-9-4-3-7;1-2-4-6-5-3-1;1-2-4-5-3-1/h7H,2-6H2,1H3;6H,1-5H2;1-4H.
What are the key properties of 2-(2-ethoxyethoxy)ethanol;piperidine;thiophene?
2-(2-ethoxyethoxy)ethanol;piperidine;thiophene has a molecular weight of 303.47 g/mol, XLogP of 2.54, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyethoxy)ethanol;piperidine;thiophene is sourced from PubChem (CID 157368980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).