4-[3-(4-propan-2-ylphenyl)propyl]morpholine

C16H25NO — CID 146185786

IUPAC4-[3-(4-propan-2-ylphenyl)propyl]morpholine
SMILESCC(C)c1ccc(CCCN2CCOCC2)cc1
InChIInChI=1S/C16H25NO/c1-14(2)16-7-5-15(6-8-16)4-3-9-17-10-12-18-13-11-17/h5-8,14H,3-4,9-13H2,1-2H3
InChIKeyRLOGAMQYWJTRRQ-UHFFFAOYSA-N
MW247.38 g/mol
LogP3.07
Rot. Bonds5

About 4-[3-(4-propan-2-ylphenyl)propyl]morpholine

4-[3-(4-propan-2-ylphenyl)propyl]morpholine (PubChem CID 146185786) has the molecular formula C16H25NO and a molecular weight of 247.38 g/mol. Its IUPAC name is 4-[3-(4-propan-2-ylphenyl)propyl]morpholine.

Molecular Properties

Compound Name4-[3-(4-propan-2-ylphenyl)propyl]morpholine
PubChem CID146185786
Molecular FormulaC16H25NO
Molecular Weight247.38 g/mol
Exact Mass247.19
IUPAC Name4-[3-(4-propan-2-ylphenyl)propyl]morpholine
SMILESCC(C)c1ccc(CCCN2CCOCC2)cc1
InChIInChI=1S/C16H25NO/c1-14(2)16-7-5-15(6-8-16)4-3-9-17-10-12-18-13-11-17/h5-8,14H,3-4,9-13H2,1-2H3
InChIKeyRLOGAMQYWJTRRQ-UHFFFAOYSA-N
XLogP3.07
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.38
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;1-[3-(4-propan-2-ylphenyl)propyl]pyrrolidine
CID 153405634
2-morpholin-4-yl-N-[(4-propan-2-ylphenyl)methyl]ethanamine;dihydrochloride
CID 2995241
4-[3-(4-iodophenyl)propyl]morpholine
CID 143873101
3-morpholin-4-yl-N-[1-(4-propan-2-ylphenyl)ethyl]propan-1-amine
CID 43205019
4-[3-[4-(4-methylpiperazin-1-yl)phenyl]propyl]morpholine
CID 170869835
4-[3-[3,5-bis(3-morpholin-4-ylpropyl)phenyl]propyl]morpholine
CID 170870147
4-[3-(2-methoxy-5-propan-2-ylphenyl)propyl]morpholine
CID 170869682
3-morpholin-4-yl-1-(4-propan-2-ylphenyl)propan-1-ol
CID 82105505
4-(4-morpholin-4-ylbutyl)phenol
CID 82188001
N-(2-morpholin-4-ylethyl)-2-(4-propan-2-ylphenyl)acetamide
CID 110766797
4-[3-[4-(2-chlorophenyl)phenyl]propyl]morpholine
CID 170869885
4-(2-bromoethyl)morpholine;methyl (2R)-3-(4-aminophenyl)-2-methylpropanoate;methyl (2R)-2-methyl-3-[4-(3-morpholin-4-ylpropyl)phenyl]propanoate
CID 161351313

Frequently Asked Questions

What is the IUPAC name of 4-[3-(4-propan-2-ylphenyl)propyl]morpholine?
The IUPAC name of 4-[3-(4-propan-2-ylphenyl)propyl]morpholine (CID 146185786) is 4-[3-(4-propan-2-ylphenyl)propyl]morpholine.
What is the SMILES notation for 4-[3-(4-propan-2-ylphenyl)propyl]morpholine?
The canonical SMILES for 4-[3-(4-propan-2-ylphenyl)propyl]morpholine is CC(C)c1ccc(CCCN2CCOCC2)cc1.
What is the InChIKey of 4-[3-(4-propan-2-ylphenyl)propyl]morpholine?
The InChIKey is RLOGAMQYWJTRRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO/c1-14(2)16-7-5-15(6-8-16)4-3-9-17-10-12-18-13-11-17/h5-8,14H,3-4,9-13H2,1-2H3.
What are the key properties of 4-[3-(4-propan-2-ylphenyl)propyl]morpholine?
4-[3-(4-propan-2-ylphenyl)propyl]morpholine has a molecular weight of 247.38 g/mol, XLogP of 3.07, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(4-propan-2-ylphenyl)propyl]morpholine is sourced from PubChem (CID 146185786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).