N-[2-fluoro-3-[(2-methylpropan-2-yl)oxy]propyl]-2-methylpropanamide

C11H22FNO2 — CID 155459768

IUPACN-[2-fluoro-3-[(2-methylpropan-2-yl)oxy]propyl]-2-methylpropanamide
SMILESCC(C)C(=O)NCC(F)COC(C)(C)C
InChIInChI=1S/C11H22FNO2/c1-8(2)10(14)13-6-9(12)7-15-11(3,4)5/h8-9H,6-7H2,1-5H3,(H,13,14)
InChIKeyXWIKVJXRANDDCS-UHFFFAOYSA-N
MW219.30 g/mol
LogP1.91
Rot. Bonds5

About N-[2-fluoro-3-[(2-methylpropan-2-yl)oxy]propyl]-2-methylpropanamide

N-[2-fluoro-3-[(2-methylpropan-2-yl)oxy]propyl]-2-methylpropanamide (PubChem CID 155459768) has the molecular formula C11H22FNO2 and a molecular weight of 219.30 g/mol. Its IUPAC name is N-[2-fluoro-3-[(2-methylpropan-2-yl)oxy]propyl]-2-methylpropanamide.

Molecular Properties

Compound NameN-[2-fluoro-3-[(2-methylpropan-2-yl)oxy]propyl]-2-methylpropanamide
PubChem CID155459768
Molecular FormulaC11H22FNO2
Molecular Weight219.30 g/mol
Exact Mass219.16
IUPAC NameN-[2-fluoro-3-[(2-methylpropan-2-yl)oxy]propyl]-2-methylpropanamide
SMILESCC(C)C(=O)NCC(F)COC(C)(C)C
InChIInChI=1S/C11H22FNO2/c1-8(2)10(14)13-6-9(12)7-15-11(3,4)5/h8-9H,6-7H2,1-5H3,(H,13,14)
InChIKeyXWIKVJXRANDDCS-UHFFFAOYSA-N
XLogP1.91
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.30
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-fluoro-3-[(2-methylpropan-2-yl)oxy]propyl]-2-methylpropanamide?
The IUPAC name of N-[2-fluoro-3-[(2-methylpropan-2-yl)oxy]propyl]-2-methylpropanamide (CID 155459768) is N-[2-fluoro-3-[(2-methylpropan-2-yl)oxy]propyl]-2-methylpropanamide.
What is the SMILES notation for N-[2-fluoro-3-[(2-methylpropan-2-yl)oxy]propyl]-2-methylpropanamide?
The canonical SMILES for N-[2-fluoro-3-[(2-methylpropan-2-yl)oxy]propyl]-2-methylpropanamide is CC(C)C(=O)NCC(F)COC(C)(C)C.
What is the InChIKey of N-[2-fluoro-3-[(2-methylpropan-2-yl)oxy]propyl]-2-methylpropanamide?
The InChIKey is XWIKVJXRANDDCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22FNO2/c1-8(2)10(14)13-6-9(12)7-15-11(3,4)5/h8-9H,6-7H2,1-5H3,(H,13,14).
What are the key properties of N-[2-fluoro-3-[(2-methylpropan-2-yl)oxy]propyl]-2-methylpropanamide?
N-[2-fluoro-3-[(2-methylpropan-2-yl)oxy]propyl]-2-methylpropanamide has a molecular weight of 219.30 g/mol, XLogP of 1.91, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-fluoro-3-[(2-methylpropan-2-yl)oxy]propyl]-2-methylpropanamide is sourced from PubChem (CID 155459768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).