benzyl 2-(1-hydroxyethyl)morpholine-4-carboxylate

C14H19NO4 — CID 18354365

IUPACbenzyl 2-(1-hydroxyethyl)morpholine-4-carboxylate
SMILESCC(O)C1CN(C(=O)OCc2ccccc2)CCO1
InChIInChI=1S/C14H19NO4/c1-11(16)13-9-15(7-8-18-13)14(17)19-10-12-5-3-2-4-6-12/h2-6,11,13,16H,7-10H2,1H3
InChIKeyDVLLIIPMJLFBOV-UHFFFAOYSA-N
MW265.31 g/mol
LogP1.40
Rot. Bonds3

About benzyl 2-(1-hydroxyethyl)morpholine-4-carboxylate

benzyl 2-(1-hydroxyethyl)morpholine-4-carboxylate (PubChem CID 18354365) has the molecular formula C14H19NO4 and a molecular weight of 265.31 g/mol. Its IUPAC name is benzyl 2-(1-hydroxyethyl)morpholine-4-carboxylate.

Molecular Properties

Compound Namebenzyl 2-(1-hydroxyethyl)morpholine-4-carboxylate
PubChem CID18354365
Molecular FormulaC14H19NO4
Molecular Weight265.31 g/mol
Exact Mass265.13
IUPAC Namebenzyl 2-(1-hydroxyethyl)morpholine-4-carboxylate
SMILESCC(O)C1CN(C(=O)OCc2ccccc2)CCO1
InChIInChI=1S/C14H19NO4/c1-11(16)13-9-15(7-8-18-13)14(17)19-10-12-5-3-2-4-6-12/h2-6,11,13,16H,7-10H2,1H3
InChIKeyDVLLIIPMJLFBOV-UHFFFAOYSA-N
XLogP1.40
TPSA59.00 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

benzyl (2S)-2-[(1R)-1-(benzylamino)ethyl]morpholine-4-carboxylate
CID 97353124
benzyl (2R)-2-ethylmorpholine-4-carboxylate
CID 164672406
benzyl (2R)-2-[(1R)-1-[(2-methyl-2-methylsulfanylpropyl)amino]ethyl]morpholine-4-carboxylate
CID 97353162
(2S)-4-phenylmethoxycarbonylmorpholine-2-carboxylate
CID 86324765
benzyl (2R)-2-[(1S)-1-[(2-methyl-2-morpholin-4-ylpropyl)amino]ethyl]morpholine-4-carboxylate
CID 97353129
benzyl (2S)-2-formylmorpholine-4-carboxylate
CID 118280798
benzyl 2-(3-bromocyclobutyl)morpholine-4-carboxylate
CID 164545661
benzyl (2S)-2-(ethoxymethyl)morpholine-4-carboxylate
CID 175632002
benzyl 3-methylpyrrolidine-1-carboxylate;ethane
CID 164877739
(4-phenylmethoxycarbonylmorpholin-2-yl)methanesulfinic acid
CID 165453803
benzyl (4aS,7aS)-4-methyl-2,3,4a,5,7,7a-hexahydropyrrolo[3,4-b][1,4]oxazine-6-carboxylate
CID 163270264
benzyl 2-(2-cyanoethyl)morpholine-4-carboxylate
CID 14882034

Frequently Asked Questions

What is the IUPAC name of benzyl 2-(1-hydroxyethyl)morpholine-4-carboxylate?
The IUPAC name of benzyl 2-(1-hydroxyethyl)morpholine-4-carboxylate (CID 18354365) is benzyl 2-(1-hydroxyethyl)morpholine-4-carboxylate.
What is the SMILES notation for benzyl 2-(1-hydroxyethyl)morpholine-4-carboxylate?
The canonical SMILES for benzyl 2-(1-hydroxyethyl)morpholine-4-carboxylate is CC(O)C1CN(C(=O)OCc2ccccc2)CCO1.
What is the InChIKey of benzyl 2-(1-hydroxyethyl)morpholine-4-carboxylate?
The InChIKey is DVLLIIPMJLFBOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO4/c1-11(16)13-9-15(7-8-18-13)14(17)19-10-12-5-3-2-4-6-12/h2-6,11,13,16H,7-10H2,1H3.
What are the key properties of benzyl 2-(1-hydroxyethyl)morpholine-4-carboxylate?
benzyl 2-(1-hydroxyethyl)morpholine-4-carboxylate has a molecular weight of 265.31 g/mol, XLogP of 1.40, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl 2-(1-hydroxyethyl)morpholine-4-carboxylate is sourced from PubChem (CID 18354365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).