2-[2-(difluoromethoxy)phenyl]-N-(6-oxo-5-azaspiro[3.5]nonan-9-yl)acetamide

C17H20F2N2O3 — CID 126799465

IUPAC2-[2-(difluoromethoxy)phenyl]-N-(6-oxo-5-azaspiro[3.5]nonan-9-yl)acetamide
SMILESO=C(Cc1ccccc1OC(F)F)NC1CCC(=O)NC12CCC2
InChIInChI=1S/C17H20F2N2O3/c18-16(19)24-12-5-2-1-4-11(12)10-15(23)20-13-6-7-14(22)21-17(13)8-3-9-17/h1-2,4-5,13,16H,3,6-10H2,(H,20,23)(H,21,22)
InChIKeyMWWZIVAGDTWHPR-UHFFFAOYSA-N
MW338.35 g/mol
LogP2.15
Rot. Bonds5

About 2-[2-(difluoromethoxy)phenyl]-N-(6-oxo-5-azaspiro[3.5]nonan-9-yl)acetamide

2-[2-(difluoromethoxy)phenyl]-N-(6-oxo-5-azaspiro[3.5]nonan-9-yl)acetamide (PubChem CID 126799465) has the molecular formula C17H20F2N2O3 and a molecular weight of 338.35 g/mol. Its IUPAC name is 2-[2-(difluoromethoxy)phenyl]-N-(6-oxo-5-azaspiro[3.5]nonan-9-yl)acetamide.

Molecular Properties

Compound Name2-[2-(difluoromethoxy)phenyl]-N-(6-oxo-5-azaspiro[3.5]nonan-9-yl)acetamide
PubChem CID126799465
Molecular FormulaC17H20F2N2O3
Molecular Weight338.35 g/mol
Exact Mass338.14
IUPAC Name2-[2-(difluoromethoxy)phenyl]-N-(6-oxo-5-azaspiro[3.5]nonan-9-yl)acetamide
SMILESO=C(Cc1ccccc1OC(F)F)NC1CCC(=O)NC12CCC2
InChIInChI=1S/C17H20F2N2O3/c18-16(19)24-12-5-2-1-4-11(12)10-15(23)20-13-6-7-14(22)21-17(13)8-3-9-17/h1-2,4-5,13,16H,3,6-10H2,(H,20,23)(H,21,22)
InChIKeyMWWZIVAGDTWHPR-UHFFFAOYSA-N
XLogP2.15
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.35
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(6-oxo-5-azaspiro[3.5]nonan-9-yl)-3-[(2-prop-2-enoxyphenyl)methyl]urea
CID 119052021
9-[[4-(difluoromethoxy)-3-fluorophenyl]methylamino]-5-azaspiro[3.5]nonan-6-one
CID 126812495
1-cyclobutyl-N-[[2-(difluoromethoxy)phenyl]methyl]methanamine
CID 43298345
N-cyclopropyl-3-[[2-(difluoromethoxy)phenyl]methylamino]propanamide
CID 78977855
4-[(6-oxo-5-azaspiro[3.5]nonan-9-yl)carbamoylamino]-5-phenylpentanoic acid
CID 122013672
2-cyclopropyl-2-[[2-[2-(difluoromethoxy)phenyl]acetyl]amino]acetic acid
CID 119214054
2-(4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-[[2-(difluoromethoxy)phenyl]methyl]acetamide
CID 18143899
N-[[2-(difluoromethoxy)phenyl]methyl]-2-(1-hydroxycyclopentyl)acetamide
CID 111430390
5-[[2-(difluoromethoxy)phenyl]methyl]-5-ethylpyrrolidin-2-one
CID 104687544
[2-[[2-(difluoromethoxy)phenyl]methylamino]-1-methylcyclopentyl]methanol
CID 111468790
2-[2-(difluoromethoxy)phenyl]-N-(piperidin-3-ylmethyl)acetamide;hydrochloride
CID 119461994
2-[2-(difluoromethoxy)phenyl]-N-[(1S,4R)-4-(hydroxymethyl)cyclopent-2-en-1-yl]acetamide
CID 111696975

Frequently Asked Questions

What is the IUPAC name of 2-[2-(difluoromethoxy)phenyl]-N-(6-oxo-5-azaspiro[3.5]nonan-9-yl)acetamide?
The IUPAC name of 2-[2-(difluoromethoxy)phenyl]-N-(6-oxo-5-azaspiro[3.5]nonan-9-yl)acetamide (CID 126799465) is 2-[2-(difluoromethoxy)phenyl]-N-(6-oxo-5-azaspiro[3.5]nonan-9-yl)acetamide.
What is the SMILES notation for 2-[2-(difluoromethoxy)phenyl]-N-(6-oxo-5-azaspiro[3.5]nonan-9-yl)acetamide?
The canonical SMILES for 2-[2-(difluoromethoxy)phenyl]-N-(6-oxo-5-azaspiro[3.5]nonan-9-yl)acetamide is O=C(Cc1ccccc1OC(F)F)NC1CCC(=O)NC12CCC2.
What is the InChIKey of 2-[2-(difluoromethoxy)phenyl]-N-(6-oxo-5-azaspiro[3.5]nonan-9-yl)acetamide?
The InChIKey is MWWZIVAGDTWHPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20F2N2O3/c18-16(19)24-12-5-2-1-4-11(12)10-15(23)20-13-6-7-14(22)21-17(13)8-3-9-17/h1-2,4-5,13,16H,3,6-10H2,(H,20,23)(H,21,22).
What are the key properties of 2-[2-(difluoromethoxy)phenyl]-N-(6-oxo-5-azaspiro[3.5]nonan-9-yl)acetamide?
2-[2-(difluoromethoxy)phenyl]-N-(6-oxo-5-azaspiro[3.5]nonan-9-yl)acetamide has a molecular weight of 338.35 g/mol, XLogP of 2.15, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(difluoromethoxy)phenyl]-N-(6-oxo-5-azaspiro[3.5]nonan-9-yl)acetamide is sourced from PubChem (CID 126799465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).