4-[3-(3-ethylmorpholin-4-yl)butyl]phenol

C16H25NO2 — CID 82976699

IUPAC4-[3-(3-ethylmorpholin-4-yl)butyl]phenol
SMILESCCC1COCCN1C(C)CCc1ccc(O)cc1
InChIInChI=1S/C16H25NO2/c1-3-15-12-19-11-10-17(15)13(2)4-5-14-6-8-16(18)9-7-14/h6-9,13,15,18H,3-5,10-12H2,1-2H3
InChIKeyJJRSOJWIBFTLLB-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.82
Rot. Bonds5

About 4-[3-(3-ethylmorpholin-4-yl)butyl]phenol

4-[3-(3-ethylmorpholin-4-yl)butyl]phenol (PubChem CID 82976699) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is 4-[3-(3-ethylmorpholin-4-yl)butyl]phenol.

Molecular Properties

Compound Name4-[3-(3-ethylmorpholin-4-yl)butyl]phenol
PubChem CID82976699
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name4-[3-(3-ethylmorpholin-4-yl)butyl]phenol
SMILESCCC1COCCN1C(C)CCc1ccc(O)cc1
InChIInChI=1S/C16H25NO2/c1-3-15-12-19-11-10-17(15)13(2)4-5-14-6-8-16(18)9-7-14/h6-9,13,15,18H,3-5,10-12H2,1-2H3
InChIKeyJJRSOJWIBFTLLB-UHFFFAOYSA-N
XLogP2.82
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-[3-(3-ethylmorpholin-4-yl)butyl]phenol with MolForge

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

Launch Full Analysis

Related Compounds

4-(3-morpholin-4-ylbutyl)phenol
CID 2846721
4-[3-[2-(aminomethyl)-4-ethylpiperidin-1-yl]butyl]phenol
CID 103351984
4-[3-(3-ethyl-4-methylpiperazin-1-yl)butyl]phenol
CID 82980555
N-ethyl-4-(3-ethylmorpholin-4-yl)pentan-1-amine
CID 62432412
2-(3-ethylmorpholin-4-yl)-N-propan-2-ylpropan-1-amine
CID 62431857
4-[3-(3-ethylpiperidin-1-yl)butyl]phenol
CID 82976975
N-[2-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine
CID 62431858
2-(3-ethylmorpholin-4-yl)-3-methyl-1-phenylbutan-1-amine
CID 43613063
2-amino-4-(3-ethylmorpholin-4-yl)-2-methylpentan-1-ol
CID 64798575
1-(3-ethylmorpholin-4-yl)-1-phenylpropan-2-amine
CID 55017138
4-[2-(2-ethylazepan-1-yl)propyl]phenol
CID 104693189
2-(3-ethylmorpholin-4-yl)-1-(4-hydroxyphenyl)ethanone
CID 43797584

Frequently Asked Questions

What is the IUPAC name of 4-[3-(3-ethylmorpholin-4-yl)butyl]phenol?
The IUPAC name of 4-[3-(3-ethylmorpholin-4-yl)butyl]phenol (CID 82976699) is 4-[3-(3-ethylmorpholin-4-yl)butyl]phenol.
What is the SMILES notation for 4-[3-(3-ethylmorpholin-4-yl)butyl]phenol?
The canonical SMILES for 4-[3-(3-ethylmorpholin-4-yl)butyl]phenol is CCC1COCCN1C(C)CCc1ccc(O)cc1.
What is the InChIKey of 4-[3-(3-ethylmorpholin-4-yl)butyl]phenol?
The InChIKey is JJRSOJWIBFTLLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-3-15-12-19-11-10-17(15)13(2)4-5-14-6-8-16(18)9-7-14/h6-9,13,15,18H,3-5,10-12H2,1-2H3.
What are the key properties of 4-[3-(3-ethylmorpholin-4-yl)butyl]phenol?
4-[3-(3-ethylmorpholin-4-yl)butyl]phenol has a molecular weight of 263.38 g/mol, XLogP of 2.82, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(3-ethylmorpholin-4-yl)butyl]phenol is sourced from PubChem (CID 82976699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).