N-(2-methyl-2-morpholin-4-ylpropyl)-2-(3-methylphenoxy)acetamide

C17H26N2O3 — CID 4792390

IUPACN-(2-methyl-2-morpholin-4-ylpropyl)-2-(3-methylphenoxy)acetamide
SMILESCc1cccc(OCC(=O)NCC(C)(C)N2CCOCC2)c1
InChIInChI=1S/C17H26N2O3/c1-14-5-4-6-15(11-14)22-12-16(20)18-13-17(2,3)19-7-9-21-10-8-19/h4-6,11H,7-10,12-13H2,1-3H3,(H,18,20)
InChIKeyFWCCXWOTXUNFAM-UHFFFAOYSA-N
MW306.41 g/mol
LogP1.60
Rot. Bonds6

About N-(2-methyl-2-morpholin-4-ylpropyl)-2-(3-methylphenoxy)acetamide

N-(2-methyl-2-morpholin-4-ylpropyl)-2-(3-methylphenoxy)acetamide (PubChem CID 4792390) has the molecular formula C17H26N2O3 and a molecular weight of 306.41 g/mol. Its IUPAC name is N-(2-methyl-2-morpholin-4-ylpropyl)-2-(3-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-(2-methyl-2-morpholin-4-ylpropyl)-2-(3-methylphenoxy)acetamide
PubChem CID4792390
Molecular FormulaC17H26N2O3
Molecular Weight306.41 g/mol
Exact Mass306.19
IUPAC NameN-(2-methyl-2-morpholin-4-ylpropyl)-2-(3-methylphenoxy)acetamide
SMILESCc1cccc(OCC(=O)NCC(C)(C)N2CCOCC2)c1
InChIInChI=1S/C17H26N2O3/c1-14-5-4-6-15(11-14)22-12-16(20)18-13-17(2,3)19-7-9-21-10-8-19/h4-6,11H,7-10,12-13H2,1-3H3,(H,18,20)
InChIKeyFWCCXWOTXUNFAM-UHFFFAOYSA-N
XLogP1.60
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-2-morpholin-4-ylpropyl)-2-(3-methylphenoxy)acetamide?
The IUPAC name of N-(2-methyl-2-morpholin-4-ylpropyl)-2-(3-methylphenoxy)acetamide (CID 4792390) is N-(2-methyl-2-morpholin-4-ylpropyl)-2-(3-methylphenoxy)acetamide.
What is the SMILES notation for N-(2-methyl-2-morpholin-4-ylpropyl)-2-(3-methylphenoxy)acetamide?
The canonical SMILES for N-(2-methyl-2-morpholin-4-ylpropyl)-2-(3-methylphenoxy)acetamide is Cc1cccc(OCC(=O)NCC(C)(C)N2CCOCC2)c1.
What is the InChIKey of N-(2-methyl-2-morpholin-4-ylpropyl)-2-(3-methylphenoxy)acetamide?
The InChIKey is FWCCXWOTXUNFAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O3/c1-14-5-4-6-15(11-14)22-12-16(20)18-13-17(2,3)19-7-9-21-10-8-19/h4-6,11H,7-10,12-13H2,1-3H3,(H,18,20).
What are the key properties of N-(2-methyl-2-morpholin-4-ylpropyl)-2-(3-methylphenoxy)acetamide?
N-(2-methyl-2-morpholin-4-ylpropyl)-2-(3-methylphenoxy)acetamide has a molecular weight of 306.41 g/mol, XLogP of 1.60, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-2-morpholin-4-ylpropyl)-2-(3-methylphenoxy)acetamide is sourced from PubChem (CID 4792390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).