2-(4-chlorophenyl)-N-(2-ethyl-6-methylphenyl)morpholine-4-carboxamide

C20H23ClN2O2 — CID 87034912

IUPAC2-(4-chlorophenyl)-N-(2-ethyl-6-methylphenyl)morpholine-4-carboxamide
SMILESCCc1cccc(C)c1NC(=O)N1CCOC(c2ccc(Cl)cc2)C1
InChIInChI=1S/C20H23ClN2O2/c1-3-15-6-4-5-14(2)19(15)22-20(24)23-11-12-25-18(13-23)16-7-9-17(21)10-8-16/h4-10,18H,3,11-13H2,1-2H3,(H,22,24)
InChIKeyFYKLLYDCRQIIFW-UHFFFAOYSA-N
MW358.87 g/mol
LogP4.82
Rot. Bonds3

About 2-(4-chlorophenyl)-N-(2-ethyl-6-methylphenyl)morpholine-4-carboxamide

2-(4-chlorophenyl)-N-(2-ethyl-6-methylphenyl)morpholine-4-carboxamide (PubChem CID 87034912) has the molecular formula C20H23ClN2O2 and a molecular weight of 358.87 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-(2-ethyl-6-methylphenyl)morpholine-4-carboxamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-(2-ethyl-6-methylphenyl)morpholine-4-carboxamide
PubChem CID87034912
Molecular FormulaC20H23ClN2O2
Molecular Weight358.87 g/mol
Exact Mass358.14
IUPAC Name2-(4-chlorophenyl)-N-(2-ethyl-6-methylphenyl)morpholine-4-carboxamide
SMILESCCc1cccc(C)c1NC(=O)N1CCOC(c2ccc(Cl)cc2)C1
InChIInChI=1S/C20H23ClN2O2/c1-3-15-6-4-5-14(2)19(15)22-20(24)23-11-12-25-18(13-23)16-7-9-17(21)10-8-16/h4-10,18H,3,11-13H2,1-2H3,(H,22,24)
InChIKeyFYKLLYDCRQIIFW-UHFFFAOYSA-N
XLogP4.82
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.87
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-chlorophenyl)-N-propylmorpholine-4-carboxamide
CID 47326521
ethyl 2-[[(2S)-2-(4-chlorophenyl)morpholine-4-carbonyl]amino]acetate
CID 94610167
N-(4-chlorophenyl)-2-(2-methylphenyl)morpholine-4-carboxamide
CID 110364497
1-[2-(4-chlorophenyl)morpholin-4-yl]butane-1,3-dione
CID 60951251
2-(3,5-dichlorophenyl)-N-(2-methylphenyl)morpholine-4-carboxamide
CID 71804721
1-[2-(4-chlorophenyl)morpholin-4-yl]-2-ethylbutan-1-one
CID 110327064
[2-(4-chlorophenyl)morpholin-4-yl]-(5-ethyl-1,3-oxazol-4-yl)methanone
CID 56746635
1-[2-(4-chlorophenyl)morpholin-4-yl]-2-hydroxyethanone
CID 56878936
2-(4-chlorophenyl)-N-(3-ethynylphenyl)morpholine-4-carboxamide
CID 87035094
N-(2-ethyl-6-methylphenyl)-3-hydroxypiperidine-1-carboxamide
CID 47192750
2-(4-chlorophenyl)-N-(2-methoxy-5-methylphenyl)morpholine-4-carboxamide
CID 87034963
N-(2-ethyl-6-methylphenyl)piperazine-1-carboxamide
CID 82086576

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-(2-ethyl-6-methylphenyl)morpholine-4-carboxamide?
The IUPAC name of 2-(4-chlorophenyl)-N-(2-ethyl-6-methylphenyl)morpholine-4-carboxamide (CID 87034912) is 2-(4-chlorophenyl)-N-(2-ethyl-6-methylphenyl)morpholine-4-carboxamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-(2-ethyl-6-methylphenyl)morpholine-4-carboxamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-(2-ethyl-6-methylphenyl)morpholine-4-carboxamide is CCc1cccc(C)c1NC(=O)N1CCOC(c2ccc(Cl)cc2)C1.
What is the InChIKey of 2-(4-chlorophenyl)-N-(2-ethyl-6-methylphenyl)morpholine-4-carboxamide?
The InChIKey is FYKLLYDCRQIIFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23ClN2O2/c1-3-15-6-4-5-14(2)19(15)22-20(24)23-11-12-25-18(13-23)16-7-9-17(21)10-8-16/h4-10,18H,3,11-13H2,1-2H3,(H,22,24).
What are the key properties of 2-(4-chlorophenyl)-N-(2-ethyl-6-methylphenyl)morpholine-4-carboxamide?
2-(4-chlorophenyl)-N-(2-ethyl-6-methylphenyl)morpholine-4-carboxamide has a molecular weight of 358.87 g/mol, XLogP of 4.82, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-(2-ethyl-6-methylphenyl)morpholine-4-carboxamide is sourced from PubChem (CID 87034912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).