N-(2-morpholin-4-yl-2-phenylethyl)-2-(2,4,6-trimethylphenoxy)acetamide

C23H30N2O3 — CID 46569876

IUPACN-(2-morpholin-4-yl-2-phenylethyl)-2-(2,4,6-trimethylphenoxy)acetamide
SMILESCc1cc(C)c(OCC(=O)NCC(c2ccccc2)N2CCOCC2)c(C)c1
InChIInChI=1S/C23H30N2O3/c1-17-13-18(2)23(19(3)14-17)28-16-22(26)24-15-21(20-7-5-4-6-8-20)25-9-11-27-12-10-25/h4-8,13-14,21H,9-12,15-16H2,1-3H3,(H,24,26)
InChIKeyUBPHRDCJXJHMON-UHFFFAOYSA-N
MW382.50 g/mol
LogP3.18
Rot. Bonds7

About N-(2-morpholin-4-yl-2-phenylethyl)-2-(2,4,6-trimethylphenoxy)acetamide

N-(2-morpholin-4-yl-2-phenylethyl)-2-(2,4,6-trimethylphenoxy)acetamide (PubChem CID 46569876) has the molecular formula C23H30N2O3 and a molecular weight of 382.50 g/mol. Its IUPAC name is N-(2-morpholin-4-yl-2-phenylethyl)-2-(2,4,6-trimethylphenoxy)acetamide.

Molecular Properties

Compound NameN-(2-morpholin-4-yl-2-phenylethyl)-2-(2,4,6-trimethylphenoxy)acetamide
PubChem CID46569876
Molecular FormulaC23H30N2O3
Molecular Weight382.50 g/mol
Exact Mass382.23
IUPAC NameN-(2-morpholin-4-yl-2-phenylethyl)-2-(2,4,6-trimethylphenoxy)acetamide
SMILESCc1cc(C)c(OCC(=O)NCC(c2ccccc2)N2CCOCC2)c(C)c1
InChIInChI=1S/C23H30N2O3/c1-17-13-18(2)23(19(3)14-17)28-16-22(26)24-15-21(20-7-5-4-6-8-20)25-9-11-27-12-10-25/h4-8,13-14,21H,9-12,15-16H2,1-3H3,(H,24,26)
InChIKeyUBPHRDCJXJHMON-UHFFFAOYSA-N
XLogP3.18
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.50
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-yl-2-phenylethyl)-2-(2,4,6-trimethylphenoxy)acetamide?
The IUPAC name of N-(2-morpholin-4-yl-2-phenylethyl)-2-(2,4,6-trimethylphenoxy)acetamide (CID 46569876) is N-(2-morpholin-4-yl-2-phenylethyl)-2-(2,4,6-trimethylphenoxy)acetamide.
What is the SMILES notation for N-(2-morpholin-4-yl-2-phenylethyl)-2-(2,4,6-trimethylphenoxy)acetamide?
The canonical SMILES for N-(2-morpholin-4-yl-2-phenylethyl)-2-(2,4,6-trimethylphenoxy)acetamide is Cc1cc(C)c(OCC(=O)NCC(c2ccccc2)N2CCOCC2)c(C)c1.
What is the InChIKey of N-(2-morpholin-4-yl-2-phenylethyl)-2-(2,4,6-trimethylphenoxy)acetamide?
The InChIKey is UBPHRDCJXJHMON-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O3/c1-17-13-18(2)23(19(3)14-17)28-16-22(26)24-15-21(20-7-5-4-6-8-20)25-9-11-27-12-10-25/h4-8,13-14,21H,9-12,15-16H2,1-3H3,(H,24,26).
What are the key properties of N-(2-morpholin-4-yl-2-phenylethyl)-2-(2,4,6-trimethylphenoxy)acetamide?
N-(2-morpholin-4-yl-2-phenylethyl)-2-(2,4,6-trimethylphenoxy)acetamide has a molecular weight of 382.50 g/mol, XLogP of 3.18, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-yl-2-phenylethyl)-2-(2,4,6-trimethylphenoxy)acetamide is sourced from PubChem (CID 46569876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).