ethane;N-[1-[3-(morpholine-4-carbonyl)phenyl]propan-2-yl]acetamide

C18H28N2O3 — CID 142839545

IUPACethane;N-[1-[3-(morpholine-4-carbonyl)phenyl]propan-2-yl]acetamide
SMILESCC.CC(=O)NC(C)Cc1cccc(C(=O)N2CCOCC2)c1
InChIInChI=1S/C16H22N2O3.C2H6/c1-12(17-13(2)19)10-14-4-3-5-15(11-14)16(20)18-6-8-21-9-7-18;1-2/h3-5,11-12H,6-10H2,1-2H3,(H,17,19);1-2H3
InChIKeyZPDDBWPLIHFWDW-UHFFFAOYSA-N
MW320.43 g/mol
LogP2.25
Rot. Bonds4

About ethane;N-[1-[3-(morpholine-4-carbonyl)phenyl]propan-2-yl]acetamide

ethane;N-[1-[3-(morpholine-4-carbonyl)phenyl]propan-2-yl]acetamide (PubChem CID 142839545) has the molecular formula C18H28N2O3 and a molecular weight of 320.43 g/mol. Its IUPAC name is ethane;N-[1-[3-(morpholine-4-carbonyl)phenyl]propan-2-yl]acetamide.

Molecular Properties

Compound Nameethane;N-[1-[3-(morpholine-4-carbonyl)phenyl]propan-2-yl]acetamide
PubChem CID142839545
Molecular FormulaC18H28N2O3
Molecular Weight320.43 g/mol
Exact Mass320.21
IUPAC Nameethane;N-[1-[3-(morpholine-4-carbonyl)phenyl]propan-2-yl]acetamide
SMILESCC.CC(=O)NC(C)Cc1cccc(C(=O)N2CCOCC2)c1
InChIInChI=1S/C16H22N2O3.C2H6/c1-12(17-13(2)19)10-14-4-3-5-15(11-14)16(20)18-6-8-21-9-7-18;1-2/h3-5,11-12H,6-10H2,1-2H3,(H,17,19);1-2H3
InChIKeyZPDDBWPLIHFWDW-UHFFFAOYSA-N
XLogP2.25
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.43
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;(3-ethylphenyl)-morpholin-4-ylmethanone
CID 143725238
ethane;N-[[3-(morpholine-4-carbonyl)phenyl]methyl]propanamide
CID 145404555
[3-(3,3-dimethylbutyl)phenyl]-morpholin-4-ylmethanone
CID 147198706
2-methyl-N-[3-(morpholine-4-carbonyl)phenyl]propanamide
CID 4094749
[3-(morpholine-4-carbonyl)phenyl]-pyrrolidin-1-ylmethanone
CID 109051623
3-[[3-(morpholine-4-carbonyl)anilino]methyl]benzoic acid
CID 122029654
N-[(2S)-1-morpholin-4-yl-1-oxo-3-phenylpropan-2-yl]acetamide
CID 110347212
[3-(hydroxyamino)phenyl]-morpholin-4-ylmethanone
CID 59690262
[3-[(3,5-dimethylpyrazol-1-yl)methyl]phenyl]-morpholin-4-ylmethanone
CID 35324290
3-(morpholine-4-carbonyl)-N-propylbenzamide
CID 109050289
2-bromo-N-[3-(morpholine-4-carbonyl)phenyl]acetamide
CID 46736679
2-(3-acetamidoanilino)-N-[3-(morpholine-4-carbonyl)phenyl]acetamide
CID 54831502

Frequently Asked Questions

What is the IUPAC name of ethane;N-[1-[3-(morpholine-4-carbonyl)phenyl]propan-2-yl]acetamide?
The IUPAC name of ethane;N-[1-[3-(morpholine-4-carbonyl)phenyl]propan-2-yl]acetamide (CID 142839545) is ethane;N-[1-[3-(morpholine-4-carbonyl)phenyl]propan-2-yl]acetamide.
What is the SMILES notation for ethane;N-[1-[3-(morpholine-4-carbonyl)phenyl]propan-2-yl]acetamide?
The canonical SMILES for ethane;N-[1-[3-(morpholine-4-carbonyl)phenyl]propan-2-yl]acetamide is CC.CC(=O)NC(C)Cc1cccc(C(=O)N2CCOCC2)c1.
What is the InChIKey of ethane;N-[1-[3-(morpholine-4-carbonyl)phenyl]propan-2-yl]acetamide?
The InChIKey is ZPDDBWPLIHFWDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O3.C2H6/c1-12(17-13(2)19)10-14-4-3-5-15(11-14)16(20)18-6-8-21-9-7-18;1-2/h3-5,11-12H,6-10H2,1-2H3,(H,17,19);1-2H3.
What are the key properties of ethane;N-[1-[3-(morpholine-4-carbonyl)phenyl]propan-2-yl]acetamide?
ethane;N-[1-[3-(morpholine-4-carbonyl)phenyl]propan-2-yl]acetamide has a molecular weight of 320.43 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-[1-[3-(morpholine-4-carbonyl)phenyl]propan-2-yl]acetamide is sourced from PubChem (CID 142839545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).