2-fluoro-2-methyl-N-[(5-methyloxolan-2-yl)methyl]propanamide

C10H18FNO2 — CID 131187349

IUPAC2-fluoro-2-methyl-N-[(5-methyloxolan-2-yl)methyl]propanamide
SMILESCC1CCC(CNC(=O)C(C)(C)F)O1
InChIInChI=1S/C10H18FNO2/c1-7-4-5-8(14-7)6-12-9(13)10(2,3)11/h7-8H,4-6H2,1-3H3,(H,12,13)
InChIKeyWTMHBQPPDBNUJQ-UHFFFAOYSA-N
MW203.26 g/mol
LogP1.42
Rot. Bonds3

About 2-fluoro-2-methyl-N-[(5-methyloxolan-2-yl)methyl]propanamide

2-fluoro-2-methyl-N-[(5-methyloxolan-2-yl)methyl]propanamide (PubChem CID 131187349) has the molecular formula C10H18FNO2 and a molecular weight of 203.26 g/mol. Its IUPAC name is 2-fluoro-2-methyl-N-[(5-methyloxolan-2-yl)methyl]propanamide.

Molecular Properties

Compound Name2-fluoro-2-methyl-N-[(5-methyloxolan-2-yl)methyl]propanamide
PubChem CID131187349
Molecular FormulaC10H18FNO2
Molecular Weight203.26 g/mol
Exact Mass203.13
IUPAC Name2-fluoro-2-methyl-N-[(5-methyloxolan-2-yl)methyl]propanamide
SMILESCC1CCC(CNC(=O)C(C)(C)F)O1
InChIInChI=1S/C10H18FNO2/c1-7-4-5-8(14-7)6-12-9(13)10(2,3)11/h7-8H,4-6H2,1-3H3,(H,12,13)
InChIKeyWTMHBQPPDBNUJQ-UHFFFAOYSA-N
XLogP1.42
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.26
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-2-methyl-N-[(5-methyloxolan-2-yl)methyl]propanamide?
The IUPAC name of 2-fluoro-2-methyl-N-[(5-methyloxolan-2-yl)methyl]propanamide (CID 131187349) is 2-fluoro-2-methyl-N-[(5-methyloxolan-2-yl)methyl]propanamide.
What is the SMILES notation for 2-fluoro-2-methyl-N-[(5-methyloxolan-2-yl)methyl]propanamide?
The canonical SMILES for 2-fluoro-2-methyl-N-[(5-methyloxolan-2-yl)methyl]propanamide is CC1CCC(CNC(=O)C(C)(C)F)O1.
What is the InChIKey of 2-fluoro-2-methyl-N-[(5-methyloxolan-2-yl)methyl]propanamide?
The InChIKey is WTMHBQPPDBNUJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18FNO2/c1-7-4-5-8(14-7)6-12-9(13)10(2,3)11/h7-8H,4-6H2,1-3H3,(H,12,13).
What are the key properties of 2-fluoro-2-methyl-N-[(5-methyloxolan-2-yl)methyl]propanamide?
2-fluoro-2-methyl-N-[(5-methyloxolan-2-yl)methyl]propanamide has a molecular weight of 203.26 g/mol, XLogP of 1.42, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2-methyl-N-[(5-methyloxolan-2-yl)methyl]propanamide is sourced from PubChem (CID 131187349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).