4-[3-[3-(4-methylphenyl)phenyl]propyl]morpholine

C20H25NO — CID 170869539

IUPAC4-[3-[3-(4-methylphenyl)phenyl]propyl]morpholine
SMILESCc1ccc(-c2cccc(CCCN3CCOCC3)c2)cc1
InChIInChI=1S/C20H25NO/c1-17-7-9-19(10-8-17)20-6-2-4-18(16-20)5-3-11-21-12-14-22-15-13-21/h2,4,6-10,16H,3,5,11-15H2,1H3
InChIKeyBZILKYWSPSXJRE-UHFFFAOYSA-N
MW295.43 g/mol
LogP3.93
Rot. Bonds5

About 4-[3-[3-(4-methylphenyl)phenyl]propyl]morpholine

4-[3-[3-(4-methylphenyl)phenyl]propyl]morpholine (PubChem CID 170869539) has the molecular formula C20H25NO and a molecular weight of 295.43 g/mol. Its IUPAC name is 4-[3-[3-(4-methylphenyl)phenyl]propyl]morpholine.

Molecular Properties

Compound Name4-[3-[3-(4-methylphenyl)phenyl]propyl]morpholine
PubChem CID170869539
Molecular FormulaC20H25NO
Molecular Weight295.43 g/mol
Exact Mass295.19
IUPAC Name4-[3-[3-(4-methylphenyl)phenyl]propyl]morpholine
SMILESCc1ccc(-c2cccc(CCCN3CCOCC3)c2)cc1
InChIInChI=1S/C20H25NO/c1-17-7-9-19(10-8-17)20-6-2-4-18(16-20)5-3-11-21-12-14-22-15-13-21/h2,4,6-10,16H,3,5,11-15H2,1H3
InChIKeyBZILKYWSPSXJRE-UHFFFAOYSA-N
XLogP3.93
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-[3-[3-(2-chlorophenyl)phenyl]propyl]morpholine
CID 170869982
4-[3-(3-pyridin-2-ylphenyl)propyl]morpholine
CID 170869904
4-[3-(3-methoxyphenyl)propyl]morpholine
CID 91901626
3-(3-morpholin-4-ylpropyl)benzonitrile
CID 86190356
4-[3-[3,5-bis(3-morpholin-4-ylpropyl)phenyl]propyl]morpholine
CID 170870147
3-[4-(2-morpholin-4-ylethyl)phenyl]phenol
CID 70092617
4-[3-[4-(1,3-benzodioxol-5-yl)phenyl]propyl]morpholine
CID 170870679
[4-[3-(morpholin-4-ylmethyl)phenyl]phenyl]methanamine
CID 39226421
4-[3-(5-methyl-3-pyridinyl)propyl]morpholine
CID 70853506
4-ethylmorpholine;1-methyl-4-phenylbenzene
CID 144997146
ethyl 2-methyl-2-[3-(3-morpholin-4-ylpropyl)phenyl]propanoate
CID 59658258
[3-[4-(morpholin-4-ylmethyl)phenyl]phenyl]methanamine
CID 10891323

Frequently Asked Questions

What is the IUPAC name of 4-[3-[3-(4-methylphenyl)phenyl]propyl]morpholine?
The IUPAC name of 4-[3-[3-(4-methylphenyl)phenyl]propyl]morpholine (CID 170869539) is 4-[3-[3-(4-methylphenyl)phenyl]propyl]morpholine.
What is the SMILES notation for 4-[3-[3-(4-methylphenyl)phenyl]propyl]morpholine?
The canonical SMILES for 4-[3-[3-(4-methylphenyl)phenyl]propyl]morpholine is Cc1ccc(-c2cccc(CCCN3CCOCC3)c2)cc1.
What is the InChIKey of 4-[3-[3-(4-methylphenyl)phenyl]propyl]morpholine?
The InChIKey is BZILKYWSPSXJRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO/c1-17-7-9-19(10-8-17)20-6-2-4-18(16-20)5-3-11-21-12-14-22-15-13-21/h2,4,6-10,16H,3,5,11-15H2,1H3.
What are the key properties of 4-[3-[3-(4-methylphenyl)phenyl]propyl]morpholine?
4-[3-[3-(4-methylphenyl)phenyl]propyl]morpholine has a molecular weight of 295.43 g/mol, XLogP of 3.93, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-[3-(4-methylphenyl)phenyl]propyl]morpholine is sourced from PubChem (CID 170869539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).