2-(4-morpholin-4-ylbutoxy)phenol

C14H21NO3 — CID 10214621

IUPAC2-(4-morpholin-4-ylbutoxy)phenol
SMILESOc1ccccc1OCCCCN1CCOCC1
InChIInChI=1S/C14H21NO3/c16-13-5-1-2-6-14(13)18-10-4-3-7-15-8-11-17-12-9-15/h1-2,5-6,16H,3-4,7-12H2
InChIKeyRUOXATBMKOQGNL-UHFFFAOYSA-N
MW251.33 g/mol
LogP1.88
Rot. Bonds6

About 2-(4-morpholin-4-ylbutoxy)phenol

2-(4-morpholin-4-ylbutoxy)phenol (PubChem CID 10214621) has the molecular formula C14H21NO3 and a molecular weight of 251.33 g/mol. Its IUPAC name is 2-(4-morpholin-4-ylbutoxy)phenol.

Molecular Properties

Compound Name2-(4-morpholin-4-ylbutoxy)phenol
PubChem CID10214621
Molecular FormulaC14H21NO3
Molecular Weight251.33 g/mol
Exact Mass251.15
IUPAC Name2-(4-morpholin-4-ylbutoxy)phenol
SMILESOc1ccccc1OCCCCN1CCOCC1
InChIInChI=1S/C14H21NO3/c16-13-5-1-2-6-14(13)18-10-4-3-7-15-8-11-17-12-9-15/h1-2,5-6,16H,3-4,7-12H2
InChIKeyRUOXATBMKOQGNL-UHFFFAOYSA-N
XLogP1.88
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 51.88
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-(8-morpholin-4-yloctoxy)phenol
CID 10193177
4-[6-(2-methylphenoxy)hexyl]morpholine
CID 5114307
4-[4-(2-propoxyphenoxy)butyl]morpholine;hydrochloride
CID 2994701
4-[4-(2-butoxyphenoxy)butyl]morpholine;hydrochloride
CID 2993517
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
5-[2-(4-morpholin-4-ylbutoxy)phenyl]-2H-triazole-4-carboxamide
CID 169403663

Frequently Asked Questions

What is the IUPAC name of 2-(4-morpholin-4-ylbutoxy)phenol?
The IUPAC name of 2-(4-morpholin-4-ylbutoxy)phenol (CID 10214621) is 2-(4-morpholin-4-ylbutoxy)phenol.
What is the SMILES notation for 2-(4-morpholin-4-ylbutoxy)phenol?
The canonical SMILES for 2-(4-morpholin-4-ylbutoxy)phenol is Oc1ccccc1OCCCCN1CCOCC1.
What is the InChIKey of 2-(4-morpholin-4-ylbutoxy)phenol?
The InChIKey is RUOXATBMKOQGNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO3/c16-13-5-1-2-6-14(13)18-10-4-3-7-15-8-11-17-12-9-15/h1-2,5-6,16H,3-4,7-12H2.
What are the key properties of 2-(4-morpholin-4-ylbutoxy)phenol?
2-(4-morpholin-4-ylbutoxy)phenol has a molecular weight of 251.33 g/mol, XLogP of 1.88, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-morpholin-4-ylbutoxy)phenol is sourced from PubChem (CID 10214621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).