4-[3-[3-(2-chlorophenyl)phenyl]propyl]morpholine

C19H22ClNO — CID 170869982

IUPAC4-[3-[3-(2-chlorophenyl)phenyl]propyl]morpholine
SMILESClc1ccccc1-c1cccc(CCCN2CCOCC2)c1
InChIInChI=1S/C19H22ClNO/c20-19-9-2-1-8-18(19)17-7-3-5-16(15-17)6-4-10-21-11-13-22-14-12-21/h1-3,5,7-9,15H,4,6,10-14H2
InChIKeyXELUKBVOXLXUSK-UHFFFAOYSA-N
MW315.84 g/mol
LogP4.27
Rot. Bonds5

About 4-[3-[3-(2-chlorophenyl)phenyl]propyl]morpholine

4-[3-[3-(2-chlorophenyl)phenyl]propyl]morpholine (PubChem CID 170869982) has the molecular formula C19H22ClNO and a molecular weight of 315.84 g/mol. Its IUPAC name is 4-[3-[3-(2-chlorophenyl)phenyl]propyl]morpholine.

Molecular Properties

Compound Name4-[3-[3-(2-chlorophenyl)phenyl]propyl]morpholine
PubChem CID170869982
Molecular FormulaC19H22ClNO
Molecular Weight315.84 g/mol
Exact Mass315.14
IUPAC Name4-[3-[3-(2-chlorophenyl)phenyl]propyl]morpholine
SMILESClc1ccccc1-c1cccc(CCCN2CCOCC2)c1
InChIInChI=1S/C19H22ClNO/c20-19-9-2-1-8-18(19)17-7-3-5-16(15-17)6-4-10-21-11-13-22-14-12-21/h1-3,5,7-9,15H,4,6,10-14H2
InChIKeyXELUKBVOXLXUSK-UHFFFAOYSA-N
XLogP4.27
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.84
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-[3-[4-(2-chlorophenyl)phenyl]propyl]morpholine
CID 170869885
4-[3-[3-(4-methylphenyl)phenyl]propyl]morpholine
CID 170869539
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-chloro-2-(3-morpholin-4-ylpropyl)phenol
CID 170869480
4-[3-(4-chloro-1-benzothiophen-2-yl)propyl]morpholine
CID 170870855
[4-[3-(3-chlorophenyl)propyl]piperazin-1-yl]-morpholin-4-ylmethanone
CID 110413923
4-[3-(1-benzylindol-6-yl)propyl]morpholine
CID 170870729
4-[3-(3-pyridin-2-yloxyphenyl)propyl]morpholine
CID 170869968
4-[3-[3-(3-morpholin-4-ylpropyl)naphthalen-2-yl]propyl]morpholine
CID 170869299

Frequently Asked Questions

What is the IUPAC name of 4-[3-[3-(2-chlorophenyl)phenyl]propyl]morpholine?
The IUPAC name of 4-[3-[3-(2-chlorophenyl)phenyl]propyl]morpholine (CID 170869982) is 4-[3-[3-(2-chlorophenyl)phenyl]propyl]morpholine.
What is the SMILES notation for 4-[3-[3-(2-chlorophenyl)phenyl]propyl]morpholine?
The canonical SMILES for 4-[3-[3-(2-chlorophenyl)phenyl]propyl]morpholine is Clc1ccccc1-c1cccc(CCCN2CCOCC2)c1.
What is the InChIKey of 4-[3-[3-(2-chlorophenyl)phenyl]propyl]morpholine?
The InChIKey is XELUKBVOXLXUSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22ClNO/c20-19-9-2-1-8-18(19)17-7-3-5-16(15-17)6-4-10-21-11-13-22-14-12-21/h1-3,5,7-9,15H,4,6,10-14H2.
What are the key properties of 4-[3-[3-(2-chlorophenyl)phenyl]propyl]morpholine?
4-[3-[3-(2-chlorophenyl)phenyl]propyl]morpholine has a molecular weight of 315.84 g/mol, XLogP of 4.27, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-[3-(2-chlorophenyl)phenyl]propyl]morpholine is sourced from PubChem (CID 170869982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).