7-(2-morpholin-4-ylethoxy)heptan-1-ol

C13H27NO3 — CID 123873926

IUPAC7-(2-morpholin-4-ylethoxy)heptan-1-ol
SMILESOCCCCCCCOCCN1CCOCC1
InChIInChI=1S/C13H27NO3/c15-9-4-2-1-3-5-10-16-11-6-14-7-12-17-13-8-14/h15H,1-13H2
InChIKeyFBALUPAMTNYBAQ-UHFFFAOYSA-N
MW245.36 g/mol
LogP1.28
Rot. Bonds10

About 7-(2-morpholin-4-ylethoxy)heptan-1-ol

7-(2-morpholin-4-ylethoxy)heptan-1-ol (PubChem CID 123873926) has the molecular formula C13H27NO3 and a molecular weight of 245.36 g/mol. Its IUPAC name is 7-(2-morpholin-4-ylethoxy)heptan-1-ol.

Molecular Properties

Compound Name7-(2-morpholin-4-ylethoxy)heptan-1-ol
PubChem CID123873926
Molecular FormulaC13H27NO3
Molecular Weight245.36 g/mol
Exact Mass245.20
IUPAC Name7-(2-morpholin-4-ylethoxy)heptan-1-ol
SMILESOCCCCCCCOCCN1CCOCC1
InChIInChI=1S/C13H27NO3/c15-9-4-2-1-3-5-10-16-11-6-14-7-12-17-13-8-14/h15H,1-13H2
InChIKeyFBALUPAMTNYBAQ-UHFFFAOYSA-N
XLogP1.28
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.36
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

9-morpholin-4-ylnonan-1-ol
CID 58205558
20-morpholin-4-ylicosan-1-ol
CID 58205553
4-(2-hexoxyethyl)morpholine
CID 3326674
6-(2-morpholin-4-ylethoxy)hexanamide
CID 67176571
ethane;4-morpholin-4-ylbutan-1-ol
CID 162683886
5-(3-morpholin-4-ylpropylamino)pentan-1-ol
CID 62227528
4-(4-ethoxybutyl)morpholine
CID 10726253
ethane;4-(2-piperazin-1-ylethoxy)butan-1-ol
CID 142367721
N-methyl-3-(2-morpholin-4-ylethoxy)propan-1-amine
CID 163400432
7-(4-pyrrolidin-1-ylbutoxymethoxy)heptan-1-ol
CID 144641470
4-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl]morpholine
CID 135134424
ethane;4-(2-propoxyethyl)morpholine
CID 154661305

Frequently Asked Questions

What is the IUPAC name of 7-(2-morpholin-4-ylethoxy)heptan-1-ol?
The IUPAC name of 7-(2-morpholin-4-ylethoxy)heptan-1-ol (CID 123873926) is 7-(2-morpholin-4-ylethoxy)heptan-1-ol.
What is the SMILES notation for 7-(2-morpholin-4-ylethoxy)heptan-1-ol?
The canonical SMILES for 7-(2-morpholin-4-ylethoxy)heptan-1-ol is OCCCCCCCOCCN1CCOCC1.
What is the InChIKey of 7-(2-morpholin-4-ylethoxy)heptan-1-ol?
The InChIKey is FBALUPAMTNYBAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO3/c15-9-4-2-1-3-5-10-16-11-6-14-7-12-17-13-8-14/h15H,1-13H2.
What are the key properties of 7-(2-morpholin-4-ylethoxy)heptan-1-ol?
7-(2-morpholin-4-ylethoxy)heptan-1-ol has a molecular weight of 245.36 g/mol, XLogP of 1.28, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-morpholin-4-ylethoxy)heptan-1-ol is sourced from PubChem (CID 123873926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).