2-(2-methoxy-5-pentan-3-ylphenyl)morpholine

C16H25NO2 — CID 117413429

IUPAC2-(2-methoxy-5-pentan-3-ylphenyl)morpholine
SMILESCCC(CC)c1ccc(OC)c(C2CNCCO2)c1
InChIInChI=1S/C16H25NO2/c1-4-12(5-2)13-6-7-15(18-3)14(10-13)16-11-17-8-9-19-16/h6-7,10,12,16-17H,4-5,8-9,11H2,1-3H3
InChIKeyHAIWBCHYZMQSRX-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.26
Rot. Bonds5

About 2-(2-methoxy-5-pentan-3-ylphenyl)morpholine

2-(2-methoxy-5-pentan-3-ylphenyl)morpholine (PubChem CID 117413429) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is 2-(2-methoxy-5-pentan-3-ylphenyl)morpholine.

Molecular Properties

Compound Name2-(2-methoxy-5-pentan-3-ylphenyl)morpholine
PubChem CID117413429
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name2-(2-methoxy-5-pentan-3-ylphenyl)morpholine
SMILESCCC(CC)c1ccc(OC)c(C2CNCCO2)c1
InChIInChI=1S/C16H25NO2/c1-4-12(5-2)13-6-7-15(18-3)14(10-13)16-11-17-8-9-19-16/h6-7,10,12,16-17H,4-5,8-9,11H2,1-3H3
InChIKeyHAIWBCHYZMQSRX-UHFFFAOYSA-N
XLogP3.26
TPSA30.49 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 ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,4-dimethoxy-5-methylphenyl)morpholine
CID 117346886
2-(2-ethoxy-3,4-dimethoxyphenyl)morpholine
CID 117421767
2-(2-methoxy-4-methylphenyl)morpholine
CID 82611084
2-(7-methoxy-2-methyl-1-benzofuran-4-yl)morpholine
CID 82622926
2-(2-chloro-4,5-dimethoxyphenyl)morpholine
CID 117397861
2-(2-fluoro-3,6-dimethoxyphenyl)morpholine
CID 84800876
2-[2-(difluoromethyl)-4,5-dimethoxyphenyl]morpholine
CID 117435420
2-(3-bromo-2,4-dimethoxyphenyl)morpholine
CID 117486500
2-[2-(1-fluoroethyl)-4,5-dimethoxyphenyl]morpholine
CID 117426455
2-[4-methoxy-3-(methoxymethyl)phenyl]morpholine
CID 117346859
2-(7-chloro-3-methoxynaphthalen-2-yl)morpholine
CID 117445267
2-(3-cyclohexyl-4-methoxyphenyl)morpholine
CID 117440824

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxy-5-pentan-3-ylphenyl)morpholine?
The IUPAC name of 2-(2-methoxy-5-pentan-3-ylphenyl)morpholine (CID 117413429) is 2-(2-methoxy-5-pentan-3-ylphenyl)morpholine.
What is the SMILES notation for 2-(2-methoxy-5-pentan-3-ylphenyl)morpholine?
The canonical SMILES for 2-(2-methoxy-5-pentan-3-ylphenyl)morpholine is CCC(CC)c1ccc(OC)c(C2CNCCO2)c1.
What is the InChIKey of 2-(2-methoxy-5-pentan-3-ylphenyl)morpholine?
The InChIKey is HAIWBCHYZMQSRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-4-12(5-2)13-6-7-15(18-3)14(10-13)16-11-17-8-9-19-16/h6-7,10,12,16-17H,4-5,8-9,11H2,1-3H3.
What are the key properties of 2-(2-methoxy-5-pentan-3-ylphenyl)morpholine?
2-(2-methoxy-5-pentan-3-ylphenyl)morpholine has a molecular weight of 263.38 g/mol, XLogP of 3.26, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxy-5-pentan-3-ylphenyl)morpholine is sourced from PubChem (CID 117413429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).