2-(8-morpholin-4-yloctoxy)phenol

C18H29NO3 — CID 10193177

IUPAC2-(8-morpholin-4-yloctoxy)phenol
SMILESOc1ccccc1OCCCCCCCCN1CCOCC1
InChIInChI=1S/C18H29NO3/c20-17-9-5-6-10-18(17)22-14-8-4-2-1-3-7-11-19-12-15-21-16-13-19/h5-6,9-10,20H,1-4,7-8,11-16H2
InChIKeySZWUGRUMUPFLHH-UHFFFAOYSA-N
MW307.43 g/mol
LogP3.44
Rot. Bonds10

About 2-(8-morpholin-4-yloctoxy)phenol

2-(8-morpholin-4-yloctoxy)phenol (PubChem CID 10193177) has the molecular formula C18H29NO3 and a molecular weight of 307.43 g/mol. Its IUPAC name is 2-(8-morpholin-4-yloctoxy)phenol.

Molecular Properties

Compound Name2-(8-morpholin-4-yloctoxy)phenol
PubChem CID10193177
Molecular FormulaC18H29NO3
Molecular Weight307.43 g/mol
Exact Mass307.21
IUPAC Name2-(8-morpholin-4-yloctoxy)phenol
SMILESOc1ccccc1OCCCCCCCCN1CCOCC1
InChIInChI=1S/C18H29NO3/c20-17-9-5-6-10-18(17)22-14-8-4-2-1-3-7-11-19-12-15-21-16-13-19/h5-6,9-10,20H,1-4,7-8,11-16H2
InChIKeySZWUGRUMUPFLHH-UHFFFAOYSA-N
XLogP3.44
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.43
LogP ≤ 53.44
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

2-(6-morpholin-4-ylhexoxy)phenol
CID 10149383
2-(4-morpholin-4-ylbutoxy)phenol
CID 10214621
4-[6-(2-methylphenoxy)hexyl]morpholine
CID 5114307
4-[4-(2-butoxyphenoxy)butyl]morpholine;hydrochloride
CID 2993517
4-[4-(2-propoxyphenoxy)butyl]morpholine;hydrochloride
CID 2994701
2-(2-hydroxyphenoxy)-N-(3-morpholin-4-ylpropyl)acetamide
CID 78784092
4-[3-[2-(3-morpholin-4-ylpropoxy)phenyl]propyl]morpholine
CID 170869645
[2-(3-morpholin-4-ylpropoxy)phenyl]-(oxan-4-yl)methanone
CID 137338787
2-(4-morpholin-4-ylbutyl)phenol
CID 142043469
N,N-dimethyl-2-(2-morpholin-4-ylethoxy)aniline
CID 147491623
4-[3-(2-nitrophenoxy)propyl]morpholine
CID 2232477
10-morpholin-4-yldecyl 2,2-diphenylacetate
CID 97355396

Frequently Asked Questions

What is the IUPAC name of 2-(8-morpholin-4-yloctoxy)phenol?
The IUPAC name of 2-(8-morpholin-4-yloctoxy)phenol (CID 10193177) is 2-(8-morpholin-4-yloctoxy)phenol.
What is the SMILES notation for 2-(8-morpholin-4-yloctoxy)phenol?
The canonical SMILES for 2-(8-morpholin-4-yloctoxy)phenol is Oc1ccccc1OCCCCCCCCN1CCOCC1.
What is the InChIKey of 2-(8-morpholin-4-yloctoxy)phenol?
The InChIKey is SZWUGRUMUPFLHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29NO3/c20-17-9-5-6-10-18(17)22-14-8-4-2-1-3-7-11-19-12-15-21-16-13-19/h5-6,9-10,20H,1-4,7-8,11-16H2.
What are the key properties of 2-(8-morpholin-4-yloctoxy)phenol?
2-(8-morpholin-4-yloctoxy)phenol has a molecular weight of 307.43 g/mol, XLogP of 3.44, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-morpholin-4-yloctoxy)phenol is sourced from PubChem (CID 10193177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).