2-[1-[2-(1-aminoethyl)morpholin-4-yl]propyl]phenol

C15H24N2O2 — CID 115314981

IUPAC2-[1-[2-(1-aminoethyl)morpholin-4-yl]propyl]phenol
SMILESCCC(c1ccccc1O)N1CCOC(C(C)N)C1
InChIInChI=1S/C15H24N2O2/c1-3-13(12-6-4-5-7-14(12)18)17-8-9-19-15(10-17)11(2)16/h4-7,11,13,15,18H,3,8-10,16H2,1-2H3
InChIKeyOXERCSMSXPOFCN-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.89
Rot. Bonds4

About 2-[1-[2-(1-aminoethyl)morpholin-4-yl]propyl]phenol

2-[1-[2-(1-aminoethyl)morpholin-4-yl]propyl]phenol (PubChem CID 115314981) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-[1-[2-(1-aminoethyl)morpholin-4-yl]propyl]phenol.

Molecular Properties

Compound Name2-[1-[2-(1-aminoethyl)morpholin-4-yl]propyl]phenol
PubChem CID115314981
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name2-[1-[2-(1-aminoethyl)morpholin-4-yl]propyl]phenol
SMILESCCC(c1ccccc1O)N1CCOC(C(C)N)C1
InChIInChI=1S/C15H24N2O2/c1-3-13(12-6-4-5-7-14(12)18)17-8-9-19-15(10-17)11(2)16/h4-7,11,13,15,18H,3,8-10,16H2,1-2H3
InChIKeyOXERCSMSXPOFCN-UHFFFAOYSA-N
XLogP1.89
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

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Related Compounds

1-[4-[1-(4-methylphenyl)propyl]morpholin-2-yl]ethanamine
CID 115314999
2-[1-(3-aminoazetidin-1-yl)propyl]phenol
CID 65244387
2-[1-[2-(1-aminoethyl)morpholin-4-yl]ethyl]benzene-1,4-diol
CID 115314817
1-(4-pentan-3-ylmorpholin-2-yl)ethanamine
CID 115315016
2-[1-(3-phenylpyrrolidin-1-yl)propyl]phenol
CID 82957556
2-[1-[2-(1-aminoethyl)morpholin-4-yl]ethyl]-4-methoxyphenol
CID 115314994
2-[1-(3-methylpiperazin-1-yl)propyl]phenol
CID 65417239
2-[1-(2-ethylmorpholin-4-yl)ethyl]phenol
CID 82976721
(2-ethoxyphenyl)-(4-propan-2-ylmorpholin-2-yl)methanamine
CID 79664711
(1S)-1-[(2S)-4-benzylmorpholin-2-yl]ethanamine
CID 95396414
2-[1-(4-propylpiperazin-1-yl)propyl]phenol
CID 82975217
2-[1-[4-(methoxymethyl)piperidin-1-yl]propyl]phenol
CID 82980997

Frequently Asked Questions

What is the IUPAC name of 2-[1-[2-(1-aminoethyl)morpholin-4-yl]propyl]phenol?
The IUPAC name of 2-[1-[2-(1-aminoethyl)morpholin-4-yl]propyl]phenol (CID 115314981) is 2-[1-[2-(1-aminoethyl)morpholin-4-yl]propyl]phenol.
What is the SMILES notation for 2-[1-[2-(1-aminoethyl)morpholin-4-yl]propyl]phenol?
The canonical SMILES for 2-[1-[2-(1-aminoethyl)morpholin-4-yl]propyl]phenol is CCC(c1ccccc1O)N1CCOC(C(C)N)C1.
What is the InChIKey of 2-[1-[2-(1-aminoethyl)morpholin-4-yl]propyl]phenol?
The InChIKey is OXERCSMSXPOFCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-3-13(12-6-4-5-7-14(12)18)17-8-9-19-15(10-17)11(2)16/h4-7,11,13,15,18H,3,8-10,16H2,1-2H3.
What are the key properties of 2-[1-[2-(1-aminoethyl)morpholin-4-yl]propyl]phenol?
2-[1-[2-(1-aminoethyl)morpholin-4-yl]propyl]phenol has a molecular weight of 264.37 g/mol, XLogP of 1.89, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[2-(1-aminoethyl)morpholin-4-yl]propyl]phenol is sourced from PubChem (CID 115314981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).