N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(2-fluorophenyl)-2-morpholin-4-ylacetamide

C20H26FN3O3 — CID 71926685

IUPACN-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(2-fluorophenyl)-2-morpholin-4-ylacetamide
SMILESCN(C)C(CNC(=O)C(c1ccccc1F)N1CCOCC1)c1ccco1
InChIInChI=1S/C20H26FN3O3/c1-23(2)17(18-8-5-11-27-18)14-22-20(25)19(24-9-12-26-13-10-24)15-6-3-4-7-16(15)21/h3-8,11,17,19H,9-10,12-14H2,1-2H3,(H,22,25)
InChIKeyAKLAWDCCXQKJJS-UHFFFAOYSA-N
MW375.44 g/mol
LogP2.21
Rot. Bonds7

About N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(2-fluorophenyl)-2-morpholin-4-ylacetamide

N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(2-fluorophenyl)-2-morpholin-4-ylacetamide (PubChem CID 71926685) has the molecular formula C20H26FN3O3 and a molecular weight of 375.44 g/mol. Its IUPAC name is N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(2-fluorophenyl)-2-morpholin-4-ylacetamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(2-fluorophenyl)-2-morpholin-4-ylacetamide
PubChem CID71926685
Molecular FormulaC20H26FN3O3
Molecular Weight375.44 g/mol
Exact Mass375.20
IUPAC NameN-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(2-fluorophenyl)-2-morpholin-4-ylacetamide
SMILESCN(C)C(CNC(=O)C(c1ccccc1F)N1CCOCC1)c1ccco1
InChIInChI=1S/C20H26FN3O3/c1-23(2)17(18-8-5-11-27-18)14-22-20(25)19(24-9-12-26-13-10-24)15-6-3-4-7-16(15)21/h3-8,11,17,19H,9-10,12-14H2,1-2H3,(H,22,25)
InChIKeyAKLAWDCCXQKJJS-UHFFFAOYSA-N
XLogP2.21
TPSA57.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.44
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(2-fluorophenyl)-2-morpholin-4-ylacetamide?
The IUPAC name of N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(2-fluorophenyl)-2-morpholin-4-ylacetamide (CID 71926685) is N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(2-fluorophenyl)-2-morpholin-4-ylacetamide.
What is the SMILES notation for N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(2-fluorophenyl)-2-morpholin-4-ylacetamide?
The canonical SMILES for N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(2-fluorophenyl)-2-morpholin-4-ylacetamide is CN(C)C(CNC(=O)C(c1ccccc1F)N1CCOCC1)c1ccco1.
What is the InChIKey of N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(2-fluorophenyl)-2-morpholin-4-ylacetamide?
The InChIKey is AKLAWDCCXQKJJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26FN3O3/c1-23(2)17(18-8-5-11-27-18)14-22-20(25)19(24-9-12-26-13-10-24)15-6-3-4-7-16(15)21/h3-8,11,17,19H,9-10,12-14H2,1-2H3,(H,22,25).
What are the key properties of N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(2-fluorophenyl)-2-morpholin-4-ylacetamide?
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(2-fluorophenyl)-2-morpholin-4-ylacetamide has a molecular weight of 375.44 g/mol, XLogP of 2.21, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(2-fluorophenyl)-2-morpholin-4-ylacetamide is sourced from PubChem (CID 71926685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).