4-(4-chlorophenyl)-5-(2,4-dichlorophenyl)-2-propylmorpholine

C19H20Cl3NO — CID 59435462

IUPAC4-(4-chlorophenyl)-5-(2,4-dichlorophenyl)-2-propylmorpholine
SMILESCCCC1CN(c2ccc(Cl)cc2)C(c2ccc(Cl)cc2Cl)CO1
InChIInChI=1S/C19H20Cl3NO/c1-2-3-16-11-23(15-7-4-13(20)5-8-15)19(12-24-16)17-9-6-14(21)10-18(17)22/h4-10,16,19H,2-3,11-12H2,1H3
InChIKeyAOKABELSSIWGMH-UHFFFAOYSA-N
MW384.73 g/mol
LogP6.39
Rot. Bonds4

About 4-(4-chlorophenyl)-5-(2,4-dichlorophenyl)-2-propylmorpholine

4-(4-chlorophenyl)-5-(2,4-dichlorophenyl)-2-propylmorpholine (PubChem CID 59435462) has the molecular formula C19H20Cl3NO and a molecular weight of 384.73 g/mol. Its IUPAC name is 4-(4-chlorophenyl)-5-(2,4-dichlorophenyl)-2-propylmorpholine.

Molecular Properties

Compound Name4-(4-chlorophenyl)-5-(2,4-dichlorophenyl)-2-propylmorpholine
PubChem CID59435462
Molecular FormulaC19H20Cl3NO
Molecular Weight384.73 g/mol
Exact Mass383.06
IUPAC Name4-(4-chlorophenyl)-5-(2,4-dichlorophenyl)-2-propylmorpholine
SMILESCCCC1CN(c2ccc(Cl)cc2)C(c2ccc(Cl)cc2Cl)CO1
InChIInChI=1S/C19H20Cl3NO/c1-2-3-16-11-23(15-7-4-13(20)5-8-15)19(12-24-16)17-9-6-14(21)10-18(17)22/h4-10,16,19H,2-3,11-12H2,1H3
InChIKeyAOKABELSSIWGMH-UHFFFAOYSA-N
XLogP6.39
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.73
LogP ≤ 56.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(4-chlorophenyl)-5-(2,4-dichlorophenyl)-2-[(3,4-difluorophenyl)methyl]morpholine;4-(4-chlorophenyl)-5-(2,4-dichlorophenyl)morpholin-3-one
CID 159349677
1-[1-(4-chlorophenyl)-6-(2,4-dichlorophenyl)piperidin-3-yl]-N-propylsulfanylmethanamine
CID 143508395
1-[1-(4-chlorophenyl)-6-(2,4-dichlorophenyl)piperidin-3-yl]-N-methylmethanamine
CID 71176030
N-[2-[(3S,6S)-1-(4-chlorophenyl)-6-(2,4-dichlorophenyl)piperidin-3-yl]ethyl]ethanesulfonamide
CID 58957061
1-[(3R,6S)-1-(4-chlorophenyl)-6-(2,4-dichlorophenyl)piperidin-3-yl]ethanone
CID 58956949
1-(4-chlorophenyl)-2-(2,4-dichlorophenyl)-5-[(4-fluoro-3-methylphenoxy)methyl]piperidine
CID 143508323
(6S)-1-(4-chlorophenyl)-6-(2,4-dichlorophenyl)piperidine-3-carboxylic acid
CID 58956898
1-[[1-(4-chlorophenyl)-6-(2,4-dichlorophenyl)piperidin-3-yl]methyl]-2,4-dimethylpiperazine
CID 58956900
1-(4-chlorophenyl)-2-(2,4-dichlorophenyl)piperidine;1-methylpiperidine
CID 143508383
(3R,6S)-1-(4-chlorophenyl)-6-(2,4-dichlorophenyl)-N-(2-methylpropyl)piperidine-3-carboxamide
CID 46230073
(2R)-2-(2-chlorophenyl)-1-(4-chlorophenyl)aziridine
CID 102086135
(5R,6R)-5,6-dibromo-2-(2,4-dichlorophenyl)-1,3-dioxepane
CID 7032956

Frequently Asked Questions

What is the IUPAC name of 4-(4-chlorophenyl)-5-(2,4-dichlorophenyl)-2-propylmorpholine?
The IUPAC name of 4-(4-chlorophenyl)-5-(2,4-dichlorophenyl)-2-propylmorpholine (CID 59435462) is 4-(4-chlorophenyl)-5-(2,4-dichlorophenyl)-2-propylmorpholine.
What is the SMILES notation for 4-(4-chlorophenyl)-5-(2,4-dichlorophenyl)-2-propylmorpholine?
The canonical SMILES for 4-(4-chlorophenyl)-5-(2,4-dichlorophenyl)-2-propylmorpholine is CCCC1CN(c2ccc(Cl)cc2)C(c2ccc(Cl)cc2Cl)CO1.
What is the InChIKey of 4-(4-chlorophenyl)-5-(2,4-dichlorophenyl)-2-propylmorpholine?
The InChIKey is AOKABELSSIWGMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20Cl3NO/c1-2-3-16-11-23(15-7-4-13(20)5-8-15)19(12-24-16)17-9-6-14(21)10-18(17)22/h4-10,16,19H,2-3,11-12H2,1H3.
What are the key properties of 4-(4-chlorophenyl)-5-(2,4-dichlorophenyl)-2-propylmorpholine?
4-(4-chlorophenyl)-5-(2,4-dichlorophenyl)-2-propylmorpholine has a molecular weight of 384.73 g/mol, XLogP of 6.39, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-chlorophenyl)-5-(2,4-dichlorophenyl)-2-propylmorpholine is sourced from PubChem (CID 59435462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).