4-(4-morpholin-4-ylbutyl)phenol

C14H21NO2 — CID 82188001

IUPAC4-(4-morpholin-4-ylbutyl)phenol
SMILESOc1ccc(CCCCN2CCOCC2)cc1
InChIInChI=1S/C14H21NO2/c16-14-6-4-13(5-7-14)3-1-2-8-15-9-11-17-12-10-15/h4-7,16H,1-3,8-12H2
InChIKeyIAGRIQGXWWHEPM-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.05
Rot. Bonds5

About 4-(4-morpholin-4-ylbutyl)phenol

4-(4-morpholin-4-ylbutyl)phenol (PubChem CID 82188001) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 4-(4-morpholin-4-ylbutyl)phenol.

Molecular Properties

Compound Name4-(4-morpholin-4-ylbutyl)phenol
PubChem CID82188001
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name4-(4-morpholin-4-ylbutyl)phenol
SMILESOc1ccc(CCCCN2CCOCC2)cc1
InChIInChI=1S/C14H21NO2/c16-14-6-4-13(5-7-14)3-1-2-8-15-9-11-17-12-10-15/h4-7,16H,1-3,8-12H2
InChIKeyIAGRIQGXWWHEPM-UHFFFAOYSA-N
XLogP2.05
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(4-hydroxyphenyl)ethyl]-N'-(2-morpholin-4-ylethyl)oxamide
CID 108503044
4-[3-(4-iodophenyl)propyl]morpholine
CID 143873101
2-[3-(4-hydroxyphenyl)propyl]-1-(3-morpholin-4-ylpropyl)guanidine
CID 111816056
2-(4-morpholin-4-ylbutyl)phenol
CID 142043469
4-[3-[3,5-bis(3-morpholin-4-ylpropyl)phenyl]propyl]morpholine
CID 170870147
4-[3-(4-propan-2-ylphenyl)propyl]morpholine
CID 146185786
2-(4-hydroxyphenyl)-N-(2-morpholin-4-ylethyl)acetamide
CID 78823248
4-[4-(6-phenylhexyl)piperazin-1-yl]phenol
CID 69479444
4-[3-[4-(4-methylpiperazin-1-yl)phenyl]propyl]morpholine
CID 170869835
4-[4-(morpholin-4-ylmethyl)phenyl]phenol
CID 39226445
3-fluoro-4-(3-morpholin-4-ylpropyl)phenol
CID 170869738
1-morpholin-4-yl-2-[4-(3-phenylpropyl)piperazin-1-yl]ethanone
CID 47014088

Frequently Asked Questions

What is the IUPAC name of 4-(4-morpholin-4-ylbutyl)phenol?
The IUPAC name of 4-(4-morpholin-4-ylbutyl)phenol (CID 82188001) is 4-(4-morpholin-4-ylbutyl)phenol.
What is the SMILES notation for 4-(4-morpholin-4-ylbutyl)phenol?
The canonical SMILES for 4-(4-morpholin-4-ylbutyl)phenol is Oc1ccc(CCCCN2CCOCC2)cc1.
What is the InChIKey of 4-(4-morpholin-4-ylbutyl)phenol?
The InChIKey is IAGRIQGXWWHEPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c16-14-6-4-13(5-7-14)3-1-2-8-15-9-11-17-12-10-15/h4-7,16H,1-3,8-12H2.
What are the key properties of 4-(4-morpholin-4-ylbutyl)phenol?
4-(4-morpholin-4-ylbutyl)phenol has a molecular weight of 235.33 g/mol, XLogP of 2.05, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-morpholin-4-ylbutyl)phenol is sourced from PubChem (CID 82188001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).