N-ethyl-4-(2-oxo-3-phenylpropyl)morpholine-3-carboxamide

C16H22N2O3 — CID 83101765

IUPACN-ethyl-4-(2-oxo-3-phenylpropyl)morpholine-3-carboxamide
SMILESCCNC(=O)C1COCCN1CC(=O)Cc1ccccc1
InChIInChI=1S/C16H22N2O3/c1-2-17-16(20)15-12-21-9-8-18(15)11-14(19)10-13-6-4-3-5-7-13/h3-7,15H,2,8-12H2,1H3,(H,17,20)
InChIKeyZCVXBKKAINEDJD-UHFFFAOYSA-N
MW290.36 g/mol
LogP0.64
Rot. Bonds6

About N-ethyl-4-(2-oxo-3-phenylpropyl)morpholine-3-carboxamide

N-ethyl-4-(2-oxo-3-phenylpropyl)morpholine-3-carboxamide (PubChem CID 83101765) has the molecular formula C16H22N2O3 and a molecular weight of 290.36 g/mol. Its IUPAC name is N-ethyl-4-(2-oxo-3-phenylpropyl)morpholine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-4-(2-oxo-3-phenylpropyl)morpholine-3-carboxamide
PubChem CID83101765
Molecular FormulaC16H22N2O3
Molecular Weight290.36 g/mol
Exact Mass290.16
IUPAC NameN-ethyl-4-(2-oxo-3-phenylpropyl)morpholine-3-carboxamide
SMILESCCNC(=O)C1COCCN1CC(=O)Cc1ccccc1
InChIInChI=1S/C16H22N2O3/c1-2-17-16(20)15-12-21-9-8-18(15)11-14(19)10-13-6-4-3-5-7-13/h3-7,15H,2,8-12H2,1H3,(H,17,20)
InChIKeyZCVXBKKAINEDJD-UHFFFAOYSA-N
XLogP0.64
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-oxo-3-phenylpropyl)morpholine-3-carboxamide
CID 83096073
N-ethyl-4-(2-oxopropyl)morpholine-3-carboxamide
CID 83103810
4-[3-(4-fluorophenyl)-2-oxopropyl]-N-methylmorpholine-3-carboxamide
CID 83101284
4-(3-amino-2-phenylpropyl)-N-ethylmorpholine-3-carboxamide
CID 83098381
(3R)-N,4-dibenzylmorpholine-3-carboxamide
CID 143132848
N-ethyl-4-[2-(5-ethylthiophen-2-yl)-2-oxoethyl]morpholine-3-carboxamide
CID 83101761
N-ethyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide
CID 83103290
4-(2-amino-2-phenylacetyl)-N-ethylmorpholine-3-carboxamide
CID 83098419
4-[(2,6-dichloro-3-pyridinyl)methyl]-N-ethylmorpholine-3-carboxamide
CID 106993901
6-[3-(ethylcarbamoyl)morpholin-4-yl]hexanoic acid
CID 83100363
4-(2-amino-1-phenylpropyl)-N-ethylmorpholine-3-carboxamide
CID 83097771
4-[(4-amino-2-chlorophenyl)methyl]-N-ethylmorpholine-3-carboxamide
CID 83106435

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-(2-oxo-3-phenylpropyl)morpholine-3-carboxamide?
The IUPAC name of N-ethyl-4-(2-oxo-3-phenylpropyl)morpholine-3-carboxamide (CID 83101765) is N-ethyl-4-(2-oxo-3-phenylpropyl)morpholine-3-carboxamide.
What is the SMILES notation for N-ethyl-4-(2-oxo-3-phenylpropyl)morpholine-3-carboxamide?
The canonical SMILES for N-ethyl-4-(2-oxo-3-phenylpropyl)morpholine-3-carboxamide is CCNC(=O)C1COCCN1CC(=O)Cc1ccccc1.
What is the InChIKey of N-ethyl-4-(2-oxo-3-phenylpropyl)morpholine-3-carboxamide?
The InChIKey is ZCVXBKKAINEDJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O3/c1-2-17-16(20)15-12-21-9-8-18(15)11-14(19)10-13-6-4-3-5-7-13/h3-7,15H,2,8-12H2,1H3,(H,17,20).
What are the key properties of N-ethyl-4-(2-oxo-3-phenylpropyl)morpholine-3-carboxamide?
N-ethyl-4-(2-oxo-3-phenylpropyl)morpholine-3-carboxamide has a molecular weight of 290.36 g/mol, XLogP of 0.64, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-(2-oxo-3-phenylpropyl)morpholine-3-carboxamide is sourced from PubChem (CID 83101765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).