N-[4-[(4-ethylphenyl)carbamoyl]phenyl]morpholine-4-carboxamide

C20H23N3O3 — CID 110178513

IUPACN-[4-[(4-ethylphenyl)carbamoyl]phenyl]morpholine-4-carboxamide
SMILESCCc1ccc(NC(=O)c2ccc(NC(=O)N3CCOCC3)cc2)cc1
InChIInChI=1S/C20H23N3O3/c1-2-15-3-7-17(8-4-15)21-19(24)16-5-9-18(10-6-16)22-20(25)23-11-13-26-14-12-23/h3-10H,2,11-14H2,1H3,(H,21,24)(H,22,25)
InChIKeyKETHXSJRXZWUKC-UHFFFAOYSA-N
MW353.42 g/mol
LogP3.37
Rot. Bonds4

About N-[4-[(4-ethylphenyl)carbamoyl]phenyl]morpholine-4-carboxamide

N-[4-[(4-ethylphenyl)carbamoyl]phenyl]morpholine-4-carboxamide (PubChem CID 110178513) has the molecular formula C20H23N3O3 and a molecular weight of 353.42 g/mol. Its IUPAC name is N-[4-[(4-ethylphenyl)carbamoyl]phenyl]morpholine-4-carboxamide.

Molecular Properties

Compound NameN-[4-[(4-ethylphenyl)carbamoyl]phenyl]morpholine-4-carboxamide
PubChem CID110178513
Molecular FormulaC20H23N3O3
Molecular Weight353.42 g/mol
Exact Mass353.17
IUPAC NameN-[4-[(4-ethylphenyl)carbamoyl]phenyl]morpholine-4-carboxamide
SMILESCCc1ccc(NC(=O)c2ccc(NC(=O)N3CCOCC3)cc2)cc1
InChIInChI=1S/C20H23N3O3/c1-2-15-3-7-17(8-4-15)21-19(24)16-5-9-18(10-6-16)22-20(25)23-11-13-26-14-12-23/h3-10H,2,11-14H2,1H3,(H,21,24)(H,22,25)
InChIKeyKETHXSJRXZWUKC-UHFFFAOYSA-N
XLogP3.37
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.42
LogP ≤ 53.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethyl-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]benzamide
CID 16612017
N-[4-(methylcarbamoyl)phenyl]morpholine-4-carboxamide
CID 47033018
N-(4-ethylphenyl)-1-(2-morpholin-4-ylethyl)-6-oxopyridine-3-carboxamide
CID 53040752
N-[4-(propylaminomethyl)phenyl]morpholine-4-carboxamide
CID 106911473
4-ethyl-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide
CID 53164786
N-(4-ethylphenyl)-4-piperidin-1-ylbenzamide
CID 53282362
4-(2-cyanoacetyl)-N-(4-ethylphenyl)piperazine-1-carboxamide
CID 166250869
4-amino-N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]benzamide
CID 119712469
N-(4-acetylphenyl)-4-(morpholin-4-ylmethyl)benzamide
CID 5132306
N-[4-(ethylcarbamoyl)phenyl]-4-morpholin-4-ylsulfonylpiperazine-1-carboxamide
CID 55818888
N-[4-[[4-(aminomethyl)benzoyl]amino]phenyl]azepane-1-carboxamide
CID 119310690
4-ethyl-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)benzamide
CID 18158878

Frequently Asked Questions

What is the IUPAC name of N-[4-[(4-ethylphenyl)carbamoyl]phenyl]morpholine-4-carboxamide?
The IUPAC name of N-[4-[(4-ethylphenyl)carbamoyl]phenyl]morpholine-4-carboxamide (CID 110178513) is N-[4-[(4-ethylphenyl)carbamoyl]phenyl]morpholine-4-carboxamide.
What is the SMILES notation for N-[4-[(4-ethylphenyl)carbamoyl]phenyl]morpholine-4-carboxamide?
The canonical SMILES for N-[4-[(4-ethylphenyl)carbamoyl]phenyl]morpholine-4-carboxamide is CCc1ccc(NC(=O)c2ccc(NC(=O)N3CCOCC3)cc2)cc1.
What is the InChIKey of N-[4-[(4-ethylphenyl)carbamoyl]phenyl]morpholine-4-carboxamide?
The InChIKey is KETHXSJRXZWUKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O3/c1-2-15-3-7-17(8-4-15)21-19(24)16-5-9-18(10-6-16)22-20(25)23-11-13-26-14-12-23/h3-10H,2,11-14H2,1H3,(H,21,24)(H,22,25).
What are the key properties of N-[4-[(4-ethylphenyl)carbamoyl]phenyl]morpholine-4-carboxamide?
N-[4-[(4-ethylphenyl)carbamoyl]phenyl]morpholine-4-carboxamide has a molecular weight of 353.42 g/mol, XLogP of 3.37, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(4-ethylphenyl)carbamoyl]phenyl]morpholine-4-carboxamide is sourced from PubChem (CID 110178513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).