ethyl 2-morpholin-2-yl-2-(1-phenylcyclopropyl)acetate

C17H23NO3 — CID 70503563

IUPACethyl 2-morpholin-2-yl-2-(1-phenylcyclopropyl)acetate
SMILESCCOC(=O)C(C1CNCCO1)C1(c2ccccc2)CC1
InChIInChI=1S/C17H23NO3/c1-2-20-16(19)15(14-12-18-10-11-21-14)17(8-9-17)13-6-4-3-5-7-13/h3-7,14-15,18H,2,8-12H2,1H3
InChIKeyINEWNAHEIKMSQL-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.89
Rot. Bonds5

About ethyl 2-morpholin-2-yl-2-(1-phenylcyclopropyl)acetate

ethyl 2-morpholin-2-yl-2-(1-phenylcyclopropyl)acetate (PubChem CID 70503563) has the molecular formula C17H23NO3 and a molecular weight of 289.38 g/mol. Its IUPAC name is ethyl 2-morpholin-2-yl-2-(1-phenylcyclopropyl)acetate.

Molecular Properties

Compound Nameethyl 2-morpholin-2-yl-2-(1-phenylcyclopropyl)acetate
PubChem CID70503563
Molecular FormulaC17H23NO3
Molecular Weight289.38 g/mol
Exact Mass289.17
IUPAC Nameethyl 2-morpholin-2-yl-2-(1-phenylcyclopropyl)acetate
SMILESCCOC(=O)C(C1CNCCO1)C1(c2ccccc2)CC1
InChIInChI=1S/C17H23NO3/c1-2-20-16(19)15(14-12-18-10-11-21-14)17(8-9-17)13-6-4-3-5-7-13/h3-7,14-15,18H,2,8-12H2,1H3
InChIKeyINEWNAHEIKMSQL-UHFFFAOYSA-N
XLogP1.89
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze ethyl 2-morpholin-2-yl-2-(1-phenylcyclopropyl)acetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethyl 2-(methylamino)-2-morpholin-2-ylacetate
CID 57144411
ethyl 1-(2-morpholin-2-ylethyl)-4-phenylpiperidine-4-carboxylate
CID 20833920
2-(1-phenylpropyl)morpholine
CID 70531832
(2R)-2-[(2-ethylphenyl)sulfanyl-phenylmethyl]morpholine
CID 69432021
(R)-morpholin-2-yl(phenyl)methanol
CID 69108289
2-[morpholin-2-yl(phenyl)methoxy]ethanol;oxalic acid
CID 67598260
3-hydroxy-2-morpholin-2-ylpropanoic acid
CID 174661676
2-[(2-ethoxy-6-fluorophenoxy)-phenylmethyl]morpholine
CID 56678217
2-[(2-ethoxy-3-fluorophenoxy)-phenylmethyl]morpholine
CID 68542255
2-morpholin-2-ylbutanamide
CID 174480619
(2R)-2-[(R)-(2-ethoxyphenoxy)-phenylmethyl]morpholine;hydrochloride
CID 46178247
(2S)-2-[(S)-(2-ethoxyphenoxy)-phenylmethyl]morpholine;methanesulfonic acid;hydrate
CID 88922222

Frequently Asked Questions

What is the IUPAC name of ethyl 2-morpholin-2-yl-2-(1-phenylcyclopropyl)acetate?
The IUPAC name of ethyl 2-morpholin-2-yl-2-(1-phenylcyclopropyl)acetate (CID 70503563) is ethyl 2-morpholin-2-yl-2-(1-phenylcyclopropyl)acetate.
What is the SMILES notation for ethyl 2-morpholin-2-yl-2-(1-phenylcyclopropyl)acetate?
The canonical SMILES for ethyl 2-morpholin-2-yl-2-(1-phenylcyclopropyl)acetate is CCOC(=O)C(C1CNCCO1)C1(c2ccccc2)CC1.
What is the InChIKey of ethyl 2-morpholin-2-yl-2-(1-phenylcyclopropyl)acetate?
The InChIKey is INEWNAHEIKMSQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23NO3/c1-2-20-16(19)15(14-12-18-10-11-21-14)17(8-9-17)13-6-4-3-5-7-13/h3-7,14-15,18H,2,8-12H2,1H3.
What are the key properties of ethyl 2-morpholin-2-yl-2-(1-phenylcyclopropyl)acetate?
ethyl 2-morpholin-2-yl-2-(1-phenylcyclopropyl)acetate has a molecular weight of 289.38 g/mol, XLogP of 1.89, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-morpholin-2-yl-2-(1-phenylcyclopropyl)acetate is sourced from PubChem (CID 70503563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).