4-[1-[(4-ethylmorpholin-2-yl)methylamino]ethyl]phenol

C15H24N2O2 — CID 114399621

IUPAC4-[1-[(4-ethylmorpholin-2-yl)methylamino]ethyl]phenol
SMILESCCN1CCOC(CNC(C)c2ccc(O)cc2)C1
InChIInChI=1S/C15H24N2O2/c1-3-17-8-9-19-15(11-17)10-16-12(2)13-4-6-14(18)7-5-13/h4-7,12,15-16,18H,3,8-11H2,1-2H3
InChIKeyKKTVPJGZNAACKA-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.76
Rot. Bonds5

About 4-[1-[(4-ethylmorpholin-2-yl)methylamino]ethyl]phenol

4-[1-[(4-ethylmorpholin-2-yl)methylamino]ethyl]phenol (PubChem CID 114399621) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 4-[1-[(4-ethylmorpholin-2-yl)methylamino]ethyl]phenol.

Molecular Properties

Compound Name4-[1-[(4-ethylmorpholin-2-yl)methylamino]ethyl]phenol
PubChem CID114399621
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name4-[1-[(4-ethylmorpholin-2-yl)methylamino]ethyl]phenol
SMILESCCN1CCOC(CNC(C)c2ccc(O)cc2)C1
InChIInChI=1S/C15H24N2O2/c1-3-17-8-9-19-15(11-17)10-16-12(2)13-4-6-14(18)7-5-13/h4-7,12,15-16,18H,3,8-11H2,1-2H3
InChIKeyKKTVPJGZNAACKA-UHFFFAOYSA-N
XLogP1.76
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[1-[(4-ethylmorpholin-2-yl)methylamino]ethyl]phenol?
The IUPAC name of 4-[1-[(4-ethylmorpholin-2-yl)methylamino]ethyl]phenol (CID 114399621) is 4-[1-[(4-ethylmorpholin-2-yl)methylamino]ethyl]phenol.
What is the SMILES notation for 4-[1-[(4-ethylmorpholin-2-yl)methylamino]ethyl]phenol?
The canonical SMILES for 4-[1-[(4-ethylmorpholin-2-yl)methylamino]ethyl]phenol is CCN1CCOC(CNC(C)c2ccc(O)cc2)C1.
What is the InChIKey of 4-[1-[(4-ethylmorpholin-2-yl)methylamino]ethyl]phenol?
The InChIKey is KKTVPJGZNAACKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-3-17-8-9-19-15(11-17)10-16-12(2)13-4-6-14(18)7-5-13/h4-7,12,15-16,18H,3,8-11H2,1-2H3.
What are the key properties of 4-[1-[(4-ethylmorpholin-2-yl)methylamino]ethyl]phenol?
4-[1-[(4-ethylmorpholin-2-yl)methylamino]ethyl]phenol has a molecular weight of 264.37 g/mol, XLogP of 1.76, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-[(4-ethylmorpholin-2-yl)methylamino]ethyl]phenol is sourced from PubChem (CID 114399621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).