3-morpholin-4-yl-1-phenylpropan-1-amine

C13H20N2O — CID 19576798

IUPAC3-morpholin-4-yl-1-phenylpropan-1-amine
SMILESNC(CCN1CCOCC1)c1ccccc1
InChIInChI=1S/C13H20N2O/c14-13(12-4-2-1-3-5-12)6-7-15-8-10-16-11-9-15/h1-5,13H,6-11,14H2
InChIKeyIVUZMSKFADOAKT-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.41
Rot. Bonds4

About 3-morpholin-4-yl-1-phenylpropan-1-amine

3-morpholin-4-yl-1-phenylpropan-1-amine (PubChem CID 19576798) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 3-morpholin-4-yl-1-phenylpropan-1-amine.

Molecular Properties

Compound Name3-morpholin-4-yl-1-phenylpropan-1-amine
PubChem CID19576798
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name3-morpholin-4-yl-1-phenylpropan-1-amine
SMILESNC(CCN1CCOCC1)c1ccccc1
InChIInChI=1S/C13H20N2O/c14-13(12-4-2-1-3-5-12)6-7-15-8-10-16-11-9-15/h1-5,13H,6-11,14H2
InChIKeyIVUZMSKFADOAKT-UHFFFAOYSA-N
XLogP1.41
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
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 3-morpholin-4-yl-1-phenylpropan-1-amine?
The IUPAC name of 3-morpholin-4-yl-1-phenylpropan-1-amine (CID 19576798) is 3-morpholin-4-yl-1-phenylpropan-1-amine.
What is the SMILES notation for 3-morpholin-4-yl-1-phenylpropan-1-amine?
The canonical SMILES for 3-morpholin-4-yl-1-phenylpropan-1-amine is NC(CCN1CCOCC1)c1ccccc1.
What is the InChIKey of 3-morpholin-4-yl-1-phenylpropan-1-amine?
The InChIKey is IVUZMSKFADOAKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c14-13(12-4-2-1-3-5-12)6-7-15-8-10-16-11-9-15/h1-5,13H,6-11,14H2.
What are the key properties of 3-morpholin-4-yl-1-phenylpropan-1-amine?
3-morpholin-4-yl-1-phenylpropan-1-amine has a molecular weight of 220.32 g/mol, XLogP of 1.41, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-morpholin-4-yl-1-phenylpropan-1-amine is sourced from PubChem (CID 19576798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).