[3-methoxy-5-(2-morpholin-4-ylethoxy)phenyl]methanol

C14H21NO4 — CID 123642977

IUPAC[3-methoxy-5-(2-morpholin-4-ylethoxy)phenyl]methanol
SMILESCOc1cc(CO)cc(OCCN2CCOCC2)c1
InChIInChI=1S/C14H21NO4/c1-17-13-8-12(11-16)9-14(10-13)19-7-4-15-2-5-18-6-3-15/h8-10,16H,2-7,11H2,1H3
InChIKeyBGQKDOXHWMGELI-UHFFFAOYSA-N
MW267.32 g/mol
LogP0.90
Rot. Bonds6

About [3-methoxy-5-(2-morpholin-4-ylethoxy)phenyl]methanol

[3-methoxy-5-(2-morpholin-4-ylethoxy)phenyl]methanol (PubChem CID 123642977) has the molecular formula C14H21NO4 and a molecular weight of 267.32 g/mol. Its IUPAC name is [3-methoxy-5-(2-morpholin-4-ylethoxy)phenyl]methanol.

Molecular Properties

Compound Name[3-methoxy-5-(2-morpholin-4-ylethoxy)phenyl]methanol
PubChem CID123642977
Molecular FormulaC14H21NO4
Molecular Weight267.32 g/mol
Exact Mass267.15
IUPAC Name[3-methoxy-5-(2-morpholin-4-ylethoxy)phenyl]methanol
SMILESCOc1cc(CO)cc(OCCN2CCOCC2)c1
InChIInChI=1S/C14H21NO4/c1-17-13-8-12(11-16)9-14(10-13)19-7-4-15-2-5-18-6-3-15/h8-10,16H,2-7,11H2,1H3
InChIKeyBGQKDOXHWMGELI-UHFFFAOYSA-N
XLogP0.90
TPSA51.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.32
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [3-methoxy-5-(2-morpholin-4-ylethoxy)phenyl]methanol?
The IUPAC name of [3-methoxy-5-(2-morpholin-4-ylethoxy)phenyl]methanol (CID 123642977) is [3-methoxy-5-(2-morpholin-4-ylethoxy)phenyl]methanol.
What is the SMILES notation for [3-methoxy-5-(2-morpholin-4-ylethoxy)phenyl]methanol?
The canonical SMILES for [3-methoxy-5-(2-morpholin-4-ylethoxy)phenyl]methanol is COc1cc(CO)cc(OCCN2CCOCC2)c1.
What is the InChIKey of [3-methoxy-5-(2-morpholin-4-ylethoxy)phenyl]methanol?
The InChIKey is BGQKDOXHWMGELI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO4/c1-17-13-8-12(11-16)9-14(10-13)19-7-4-15-2-5-18-6-3-15/h8-10,16H,2-7,11H2,1H3.
What are the key properties of [3-methoxy-5-(2-morpholin-4-ylethoxy)phenyl]methanol?
[3-methoxy-5-(2-morpholin-4-ylethoxy)phenyl]methanol has a molecular weight of 267.32 g/mol, XLogP of 0.90, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-methoxy-5-(2-morpholin-4-ylethoxy)phenyl]methanol is sourced from PubChem (CID 123642977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).