2-(4-phenylmethoxy-3-propylphenyl)morpholine

C20H25NO2 — CID 69353396

IUPAC2-(4-phenylmethoxy-3-propylphenyl)morpholine
SMILESCCCc1cc(C2CNCCO2)ccc1OCc1ccccc1
InChIInChI=1S/C20H25NO2/c1-2-6-17-13-18(20-14-21-11-12-22-20)9-10-19(17)23-15-16-7-4-3-5-8-16/h3-5,7-10,13,20-21H,2,6,11-12,14-15H2,1H3
InChIKeyGFYHHZAHXMIZCQ-UHFFFAOYSA-N
MW311.43 g/mol
LogP3.88
Rot. Bonds6

About 2-(4-phenylmethoxy-3-propylphenyl)morpholine

2-(4-phenylmethoxy-3-propylphenyl)morpholine (PubChem CID 69353396) has the molecular formula C20H25NO2 and a molecular weight of 311.43 g/mol. Its IUPAC name is 2-(4-phenylmethoxy-3-propylphenyl)morpholine.

Molecular Properties

Compound Name2-(4-phenylmethoxy-3-propylphenyl)morpholine
PubChem CID69353396
Molecular FormulaC20H25NO2
Molecular Weight311.43 g/mol
Exact Mass311.19
IUPAC Name2-(4-phenylmethoxy-3-propylphenyl)morpholine
SMILESCCCc1cc(C2CNCCO2)ccc1OCc1ccccc1
InChIInChI=1S/C20H25NO2/c1-2-6-17-13-18(20-14-21-11-12-22-20)9-10-19(17)23-15-16-7-4-3-5-8-16/h3-5,7-10,13,20-21H,2,6,11-12,14-15H2,1H3
InChIKeyGFYHHZAHXMIZCQ-UHFFFAOYSA-N
XLogP3.88
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-morpholin-2-yl-2-phenylmethoxyphenol
CID 117459594
2-[4-methoxy-3-(methoxymethyl)phenyl]morpholine
CID 117346859
5-[3-[3-(4-morpholin-2-yl-2-propylphenoxy)propoxy]phenyl]-1,3-oxazolidine-2,4-dione
CID 69354065
2-(3-chloro-4-ethoxyphenyl)morpholine
CID 82293187
[5-(oxiran-2-yl)-2-phenylmethoxyphenyl]methanol
CID 18628101
azane;2-phenylmorpholine
CID 174664757
2-[3-chloro-4-[(2,6-dichlorophenyl)methoxy]phenyl]morpholine;2-[4-[2-(2,6-dichlorophenyl)ethyl]phenyl]morpholine;2-[4-[(2,6-dichlorophenyl)methyl]phenyl]morpholine
CID 157346980
(2S)-2-[3-chloro-4-[(2-chloro-6-fluorophenyl)methoxy]phenyl]morpholine
CID 124564123
2-(3,4-dimethylphenyl)morpholine
CID 43169342
N,N-dimethyl-2-(4-morpholin-2-ylphenyl)-1-phenylpentan-3-amine
CID 174876057
(2S)-2-[4-[(6-chloro-5-ethoxy-3-pyridinyl)methyl]phenyl]morpholine
CID 147052117
N-(4-phenylmethoxy-3-propylphenyl)acetamide
CID 57080743

Frequently Asked Questions

What is the IUPAC name of 2-(4-phenylmethoxy-3-propylphenyl)morpholine?
The IUPAC name of 2-(4-phenylmethoxy-3-propylphenyl)morpholine (CID 69353396) is 2-(4-phenylmethoxy-3-propylphenyl)morpholine.
What is the SMILES notation for 2-(4-phenylmethoxy-3-propylphenyl)morpholine?
The canonical SMILES for 2-(4-phenylmethoxy-3-propylphenyl)morpholine is CCCc1cc(C2CNCCO2)ccc1OCc1ccccc1.
What is the InChIKey of 2-(4-phenylmethoxy-3-propylphenyl)morpholine?
The InChIKey is GFYHHZAHXMIZCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO2/c1-2-6-17-13-18(20-14-21-11-12-22-20)9-10-19(17)23-15-16-7-4-3-5-8-16/h3-5,7-10,13,20-21H,2,6,11-12,14-15H2,1H3.
What are the key properties of 2-(4-phenylmethoxy-3-propylphenyl)morpholine?
2-(4-phenylmethoxy-3-propylphenyl)morpholine has a molecular weight of 311.43 g/mol, XLogP of 3.88, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-phenylmethoxy-3-propylphenyl)morpholine is sourced from PubChem (CID 69353396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).