1-morpholin-4-yl-1-phenylpropan-2-amine

C13H20N2O — CID 3697140

IUPAC1-morpholin-4-yl-1-phenylpropan-2-amine
SMILESCC(N)C(c1ccccc1)N1CCOCC1
InChIInChI=1S/C13H20N2O/c1-11(14)13(12-5-3-2-4-6-12)15-7-9-16-10-8-15/h2-6,11,13H,7-10,14H2,1H3
InChIKeyKPUFYSBGJJQBJI-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.41
Rot. Bonds3

About 1-morpholin-4-yl-1-phenylpropan-2-amine

1-morpholin-4-yl-1-phenylpropan-2-amine (PubChem CID 3697140) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 1-morpholin-4-yl-1-phenylpropan-2-amine.

Molecular Properties

Compound Name1-morpholin-4-yl-1-phenylpropan-2-amine
PubChem CID3697140
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name1-morpholin-4-yl-1-phenylpropan-2-amine
SMILESCC(N)C(c1ccccc1)N1CCOCC1
InChIInChI=1S/C13H20N2O/c1-11(14)13(12-5-3-2-4-6-12)15-7-9-16-10-8-15/h2-6,11,13H,7-10,14H2,1H3
InChIKeyKPUFYSBGJJQBJI-UHFFFAOYSA-N
XLogP1.41
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-yl-1-phenylpropan-2-amine?
The IUPAC name of 1-morpholin-4-yl-1-phenylpropan-2-amine (CID 3697140) is 1-morpholin-4-yl-1-phenylpropan-2-amine.
What is the SMILES notation for 1-morpholin-4-yl-1-phenylpropan-2-amine?
The canonical SMILES for 1-morpholin-4-yl-1-phenylpropan-2-amine is CC(N)C(c1ccccc1)N1CCOCC1.
What is the InChIKey of 1-morpholin-4-yl-1-phenylpropan-2-amine?
The InChIKey is KPUFYSBGJJQBJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-11(14)13(12-5-3-2-4-6-12)15-7-9-16-10-8-15/h2-6,11,13H,7-10,14H2,1H3.
What are the key properties of 1-morpholin-4-yl-1-phenylpropan-2-amine?
1-morpholin-4-yl-1-phenylpropan-2-amine has a molecular weight of 220.32 g/mol, XLogP of 1.41, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-yl-1-phenylpropan-2-amine is sourced from PubChem (CID 3697140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).