2-morpholin-4-ylethyl 4-methoxybenzoate

C14H19NO4 — CID 739087

IUPAC2-morpholin-4-ylethyl 4-methoxybenzoate
SMILESCOc1ccc(C(=O)OCCN2CCOCC2)cc1
InChIInChI=1S/C14H19NO4/c1-17-13-4-2-12(3-5-13)14(16)19-11-8-15-6-9-18-10-7-15/h2-5H,6-11H2,1H3
InChIKeyDPHOKLZALQVXFM-UHFFFAOYSA-N
MW265.31 g/mol
LogP1.18
Rot. Bonds5

About 2-morpholin-4-ylethyl 4-methoxybenzoate

2-morpholin-4-ylethyl 4-methoxybenzoate (PubChem CID 739087) has the molecular formula C14H19NO4 and a molecular weight of 265.31 g/mol. Its IUPAC name is 2-morpholin-4-ylethyl 4-methoxybenzoate.

Molecular Properties

Compound Name2-morpholin-4-ylethyl 4-methoxybenzoate
PubChem CID739087
Molecular FormulaC14H19NO4
Molecular Weight265.31 g/mol
Exact Mass265.13
IUPAC Name2-morpholin-4-ylethyl 4-methoxybenzoate
SMILESCOc1ccc(C(=O)OCCN2CCOCC2)cc1
InChIInChI=1S/C14H19NO4/c1-17-13-4-2-12(3-5-13)14(16)19-11-8-15-6-9-18-10-7-15/h2-5H,6-11H2,1H3
InChIKeyDPHOKLZALQVXFM-UHFFFAOYSA-N
XLogP1.18
TPSA48.00 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 51.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-morpholin-4-ylethyl 4-methoxybenzoate;hydrochloride
CID 2836400
2-morpholin-4-ylethyl 3,5-dimethoxybenzoate
CID 50896866
2-morpholin-4-ylethyl 4-(trifluoromethoxy)benzoate
CID 166930213
2-morpholin-4-ylethyl 3-amino-4-methoxybenzoate
CID 61321668
hydron;2-morpholin-4-ylethyl 3,4-dimethoxybenzoate;chloride
CID 660605
2-morpholin-4-ylethyl 4-ethynylbenzoate;hydrochloride
CID 71386007
2-morpholin-4-ylethyl 4-(1-methyltetrazol-5-yl)benzoate
CID 58740461
2-(1,4,7,10,13-pentaoxa-16-azacyclooctadec-16-yl)ethyl 7-methoxy-2-oxochromene-3-carboxylate
CID 12073682
1-morpholin-4-ylpropan-2-yl 4-methoxybenzoate chloride
CID 53352536
4-(2-morpholin-4-ylethoxy)benzamide
CID 35813066
2-morpholin-4-ylethyl 2-oxotricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,9,11,13-heptaene-6-carboxylate
CID 54469991
4-[3-(4-methoxyphenoxy)propyl]morpholine
CID 2053845

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-ylethyl 4-methoxybenzoate?
The IUPAC name of 2-morpholin-4-ylethyl 4-methoxybenzoate (CID 739087) is 2-morpholin-4-ylethyl 4-methoxybenzoate.
What is the SMILES notation for 2-morpholin-4-ylethyl 4-methoxybenzoate?
The canonical SMILES for 2-morpholin-4-ylethyl 4-methoxybenzoate is COc1ccc(C(=O)OCCN2CCOCC2)cc1.
What is the InChIKey of 2-morpholin-4-ylethyl 4-methoxybenzoate?
The InChIKey is DPHOKLZALQVXFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO4/c1-17-13-4-2-12(3-5-13)14(16)19-11-8-15-6-9-18-10-7-15/h2-5H,6-11H2,1H3.
What are the key properties of 2-morpholin-4-ylethyl 4-methoxybenzoate?
2-morpholin-4-ylethyl 4-methoxybenzoate has a molecular weight of 265.31 g/mol, XLogP of 1.18, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-ylethyl 4-methoxybenzoate is sourced from PubChem (CID 739087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).