1-(4-chlorophenyl)-1-(2,2-dimethylmorpholin-4-yl)propan-2-amine

C15H23ClN2O — CID 55015046

IUPAC1-(4-chlorophenyl)-1-(2,2-dimethylmorpholin-4-yl)propan-2-amine
SMILESCC(N)C(c1ccc(Cl)cc1)N1CCOC(C)(C)C1
InChIInChI=1S/C15H23ClN2O/c1-11(17)14(12-4-6-13(16)7-5-12)18-8-9-19-15(2,3)10-18/h4-7,11,14H,8-10,17H2,1-3H3
InChIKeyHFYUPEGGDHFKFS-UHFFFAOYSA-N
MW282.81 g/mol
LogP2.84
Rot. Bonds3

About 1-(4-chlorophenyl)-1-(2,2-dimethylmorpholin-4-yl)propan-2-amine

1-(4-chlorophenyl)-1-(2,2-dimethylmorpholin-4-yl)propan-2-amine (PubChem CID 55015046) has the molecular formula C15H23ClN2O and a molecular weight of 282.81 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-1-(2,2-dimethylmorpholin-4-yl)propan-2-amine.

Molecular Properties

Compound Name1-(4-chlorophenyl)-1-(2,2-dimethylmorpholin-4-yl)propan-2-amine
PubChem CID55015046
Molecular FormulaC15H23ClN2O
Molecular Weight282.81 g/mol
Exact Mass282.15
IUPAC Name1-(4-chlorophenyl)-1-(2,2-dimethylmorpholin-4-yl)propan-2-amine
SMILESCC(N)C(c1ccc(Cl)cc1)N1CCOC(C)(C)C1
InChIInChI=1S/C15H23ClN2O/c1-11(17)14(12-4-6-13(16)7-5-12)18-8-9-19-15(2,3)10-18/h4-7,11,14H,8-10,17H2,1-3H3
InChIKeyHFYUPEGGDHFKFS-UHFFFAOYSA-N
XLogP2.84
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.81
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-1-(2,2-dimethylmorpholin-4-yl)propan-2-amine?
The IUPAC name of 1-(4-chlorophenyl)-1-(2,2-dimethylmorpholin-4-yl)propan-2-amine (CID 55015046) is 1-(4-chlorophenyl)-1-(2,2-dimethylmorpholin-4-yl)propan-2-amine.
What is the SMILES notation for 1-(4-chlorophenyl)-1-(2,2-dimethylmorpholin-4-yl)propan-2-amine?
The canonical SMILES for 1-(4-chlorophenyl)-1-(2,2-dimethylmorpholin-4-yl)propan-2-amine is CC(N)C(c1ccc(Cl)cc1)N1CCOC(C)(C)C1.
What is the InChIKey of 1-(4-chlorophenyl)-1-(2,2-dimethylmorpholin-4-yl)propan-2-amine?
The InChIKey is HFYUPEGGDHFKFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23ClN2O/c1-11(17)14(12-4-6-13(16)7-5-12)18-8-9-19-15(2,3)10-18/h4-7,11,14H,8-10,17H2,1-3H3.
What are the key properties of 1-(4-chlorophenyl)-1-(2,2-dimethylmorpholin-4-yl)propan-2-amine?
1-(4-chlorophenyl)-1-(2,2-dimethylmorpholin-4-yl)propan-2-amine has a molecular weight of 282.81 g/mol, XLogP of 2.84, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-1-(2,2-dimethylmorpholin-4-yl)propan-2-amine is sourced from PubChem (CID 55015046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).