N-[[4-(difluoromethoxy)phenyl]methyl]-2-[ethyl(oxolan-3-ylmethyl)amino]acetamide

C17H24F2N2O3 — CID 60502800

IUPACN-[[4-(difluoromethoxy)phenyl]methyl]-2-[ethyl(oxolan-3-ylmethyl)amino]acetamide
SMILESCCN(CC(=O)NCc1ccc(OC(F)F)cc1)CC1CCOC1
InChIInChI=1S/C17H24F2N2O3/c1-2-21(10-14-7-8-23-12-14)11-16(22)20-9-13-3-5-15(6-4-13)24-17(18)19/h3-6,14,17H,2,7-12H2,1H3,(H,20,22)
InChIKeyRXYUDAIQDBNKBV-UHFFFAOYSA-N
MW342.39 g/mol
LogP2.26
Rot. Bonds9

About N-[[4-(difluoromethoxy)phenyl]methyl]-2-[ethyl(oxolan-3-ylmethyl)amino]acetamide

N-[[4-(difluoromethoxy)phenyl]methyl]-2-[ethyl(oxolan-3-ylmethyl)amino]acetamide (PubChem CID 60502800) has the molecular formula C17H24F2N2O3 and a molecular weight of 342.39 g/mol. Its IUPAC name is N-[[4-(difluoromethoxy)phenyl]methyl]-2-[ethyl(oxolan-3-ylmethyl)amino]acetamide.

Molecular Properties

Compound NameN-[[4-(difluoromethoxy)phenyl]methyl]-2-[ethyl(oxolan-3-ylmethyl)amino]acetamide
PubChem CID60502800
Molecular FormulaC17H24F2N2O3
Molecular Weight342.39 g/mol
Exact Mass342.18
IUPAC NameN-[[4-(difluoromethoxy)phenyl]methyl]-2-[ethyl(oxolan-3-ylmethyl)amino]acetamide
SMILESCCN(CC(=O)NCc1ccc(OC(F)F)cc1)CC1CCOC1
InChIInChI=1S/C17H24F2N2O3/c1-2-21(10-14-7-8-23-12-14)11-16(22)20-9-13-3-5-15(6-4-13)24-17(18)19/h3-6,14,17H,2,7-12H2,1H3,(H,20,22)
InChIKeyRXYUDAIQDBNKBV-UHFFFAOYSA-N
XLogP2.26
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.39
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[4-(difluoromethoxy)phenyl]methyl]-2-[ethyl(oxolan-3-ylmethyl)amino]acetamide?
The IUPAC name of N-[[4-(difluoromethoxy)phenyl]methyl]-2-[ethyl(oxolan-3-ylmethyl)amino]acetamide (CID 60502800) is N-[[4-(difluoromethoxy)phenyl]methyl]-2-[ethyl(oxolan-3-ylmethyl)amino]acetamide.
What is the SMILES notation for N-[[4-(difluoromethoxy)phenyl]methyl]-2-[ethyl(oxolan-3-ylmethyl)amino]acetamide?
The canonical SMILES for N-[[4-(difluoromethoxy)phenyl]methyl]-2-[ethyl(oxolan-3-ylmethyl)amino]acetamide is CCN(CC(=O)NCc1ccc(OC(F)F)cc1)CC1CCOC1.
What is the InChIKey of N-[[4-(difluoromethoxy)phenyl]methyl]-2-[ethyl(oxolan-3-ylmethyl)amino]acetamide?
The InChIKey is RXYUDAIQDBNKBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24F2N2O3/c1-2-21(10-14-7-8-23-12-14)11-16(22)20-9-13-3-5-15(6-4-13)24-17(18)19/h3-6,14,17H,2,7-12H2,1H3,(H,20,22).
What are the key properties of N-[[4-(difluoromethoxy)phenyl]methyl]-2-[ethyl(oxolan-3-ylmethyl)amino]acetamide?
N-[[4-(difluoromethoxy)phenyl]methyl]-2-[ethyl(oxolan-3-ylmethyl)amino]acetamide has a molecular weight of 342.39 g/mol, XLogP of 2.26, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(difluoromethoxy)phenyl]methyl]-2-[ethyl(oxolan-3-ylmethyl)amino]acetamide is sourced from PubChem (CID 60502800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).