4-[4-(2-piperidin-2-ylphenyl)phenyl]morpholine

C21H26N2O — CID 173116240

IUPAC4-[4-(2-piperidin-2-ylphenyl)phenyl]morpholine
SMILESc1ccc(C2CCCCN2)c(-c2ccc(N3CCOCC3)cc2)c1
InChIInChI=1S/C21H26N2O/c1-2-6-20(21-7-3-4-12-22-21)19(5-1)17-8-10-18(11-9-17)23-13-15-24-16-14-23/h1-2,5-6,8-11,21-22H,3-4,7,12-16H2
InChIKeyQSSLUPZXWVHUAK-UHFFFAOYSA-N
MW322.45 g/mol
LogP4.00
Rot. Bonds3

About 4-[4-(2-piperidin-2-ylphenyl)phenyl]morpholine

4-[4-(2-piperidin-2-ylphenyl)phenyl]morpholine (PubChem CID 173116240) has the molecular formula C21H26N2O and a molecular weight of 322.45 g/mol. Its IUPAC name is 4-[4-(2-piperidin-2-ylphenyl)phenyl]morpholine.

Molecular Properties

Compound Name4-[4-(2-piperidin-2-ylphenyl)phenyl]morpholine
PubChem CID173116240
Molecular FormulaC21H26N2O
Molecular Weight322.45 g/mol
Exact Mass322.20
IUPAC Name4-[4-(2-piperidin-2-ylphenyl)phenyl]morpholine
SMILESc1ccc(C2CCCCN2)c(-c2ccc(N3CCOCC3)cc2)c1
InChIInChI=1S/C21H26N2O/c1-2-6-20(21-7-3-4-12-22-21)19(5-1)17-8-10-18(11-9-17)23-13-15-24-16-14-23/h1-2,5-6,8-11,21-22H,3-4,7,12-16H2
InChIKeyQSSLUPZXWVHUAK-UHFFFAOYSA-N
XLogP4.00
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.45
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[2-[(2R)-pyrrolidin-2-yl]phenyl]morpholine
CID 96807241
2-(2-cyclopentylphenyl)piperidine
CID 115005914
2-[2-(fluoromethyl)phenyl]piperidine
CID 84664975
4-phenyl-3-piperidin-2-ylpyridine
CID 115009262
13-[4-[4-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)phenyl]phenyl]-1,4,7,10-tetraoxa-13-azacyclopentadecane
CID 102533214
(2S)-2-(2-methylsulfanylphenyl)piperidine
CID 7048099
2-(2-pyrrolidin-2-ylphenyl)benzenethiol
CID 175093936
2-[2-(difluoromethylsulfanyl)phenyl]pyrrolidine
CID 117330926
(2S)-2-[2-[2-(trifluoromethyl)phenyl]phenyl]pyrrolidine
CID 126961273
(2S)-N-(4-morpholin-4-ylphenyl)piperidine-2-carboxamide
CID 103813196
(2R)-N-(4-morpholin-4-ylphenyl)piperidine-2-carboxamide
CID 103813194
1-[(2-piperidin-2-ylphenyl)methyl]piperidine
CID 117400046

Frequently Asked Questions

What is the IUPAC name of 4-[4-(2-piperidin-2-ylphenyl)phenyl]morpholine?
The IUPAC name of 4-[4-(2-piperidin-2-ylphenyl)phenyl]morpholine (CID 173116240) is 4-[4-(2-piperidin-2-ylphenyl)phenyl]morpholine.
What is the SMILES notation for 4-[4-(2-piperidin-2-ylphenyl)phenyl]morpholine?
The canonical SMILES for 4-[4-(2-piperidin-2-ylphenyl)phenyl]morpholine is c1ccc(C2CCCCN2)c(-c2ccc(N3CCOCC3)cc2)c1.
What is the InChIKey of 4-[4-(2-piperidin-2-ylphenyl)phenyl]morpholine?
The InChIKey is QSSLUPZXWVHUAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O/c1-2-6-20(21-7-3-4-12-22-21)19(5-1)17-8-10-18(11-9-17)23-13-15-24-16-14-23/h1-2,5-6,8-11,21-22H,3-4,7,12-16H2.
What are the key properties of 4-[4-(2-piperidin-2-ylphenyl)phenyl]morpholine?
4-[4-(2-piperidin-2-ylphenyl)phenyl]morpholine has a molecular weight of 322.45 g/mol, XLogP of 4.00, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(2-piperidin-2-ylphenyl)phenyl]morpholine is sourced from PubChem (CID 173116240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).