2-fluoro-N,2-dimethyl-N-(oxan-4-yl)propanamide

C10H18FNO2 — CID 130165390

IUPAC2-fluoro-N,2-dimethyl-N-(oxan-4-yl)propanamide
SMILESCN(C(=O)C(C)(C)F)C1CCOCC1
InChIInChI=1S/C10H18FNO2/c1-10(2,11)9(13)12(3)8-4-6-14-7-5-8/h8H,4-7H2,1-3H3
InChIKeyQIEQSNOUAPDZBD-UHFFFAOYSA-N
MW203.26 g/mol
LogP1.37
Rot. Bonds2

About 2-fluoro-N,2-dimethyl-N-(oxan-4-yl)propanamide

2-fluoro-N,2-dimethyl-N-(oxan-4-yl)propanamide (PubChem CID 130165390) has the molecular formula C10H18FNO2 and a molecular weight of 203.26 g/mol. Its IUPAC name is 2-fluoro-N,2-dimethyl-N-(oxan-4-yl)propanamide.

Molecular Properties

Compound Name2-fluoro-N,2-dimethyl-N-(oxan-4-yl)propanamide
PubChem CID130165390
Molecular FormulaC10H18FNO2
Molecular Weight203.26 g/mol
Exact Mass203.13
IUPAC Name2-fluoro-N,2-dimethyl-N-(oxan-4-yl)propanamide
SMILESCN(C(=O)C(C)(C)F)C1CCOCC1
InChIInChI=1S/C10H18FNO2/c1-10(2,11)9(13)12(3)8-4-6-14-7-5-8/h8H,4-7H2,1-3H3
InChIKeyQIEQSNOUAPDZBD-UHFFFAOYSA-N
XLogP1.37
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.26
LogP ≤ 51.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

US10214537, Example 160
CID 132220336
2,2,2-trifluoro-N-methyl-N-(oxan-4-yl)acetamide
CID 64591128
N-(ethoxymethyl)-2,2,2-trifluoro-N-(oxan-4-yl)acetamide
CID 90102498
N-(3-fluorooxan-4-yl)-2-methylpropanamide
CID 124162800
N-ethyl-2,2,2-trifluoro-N-(oxan-4-yl)acetamide
CID 164002132
N-(oxan-4-yl)-N-(2,2,2-trifluoroethyl)cyclopropanecarboxamide
CID 71796091
N-(oxan-4-yl)-N-(2,2,2-trifluoroethyl)acetamide
CID 90554678
N-(oxan-4-yl)-N-(2,2,2-trifluoroethyl)butanamide
CID 90554679
N-(oxan-4-yl)-N-(2,2,2-trifluoroethyl)propanamide
CID 90554680
2-methyl-N-(oxan-4-yl)-N-(2,2,2-trifluoroethyl)propanamide
CID 90554681
N-(oxan-4-yl)-N-(2,2,2-trifluoroethyl)pentanamide
CID 90554682
2,2-dimethyl-N-(oxan-4-yl)-N-(2,2,2-trifluoroethyl)propanamide
CID 90554683

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N,2-dimethyl-N-(oxan-4-yl)propanamide?
The IUPAC name of 2-fluoro-N,2-dimethyl-N-(oxan-4-yl)propanamide (CID 130165390) is 2-fluoro-N,2-dimethyl-N-(oxan-4-yl)propanamide.
What is the SMILES notation for 2-fluoro-N,2-dimethyl-N-(oxan-4-yl)propanamide?
The canonical SMILES for 2-fluoro-N,2-dimethyl-N-(oxan-4-yl)propanamide is CN(C(=O)C(C)(C)F)C1CCOCC1.
What is the InChIKey of 2-fluoro-N,2-dimethyl-N-(oxan-4-yl)propanamide?
The InChIKey is QIEQSNOUAPDZBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18FNO2/c1-10(2,11)9(13)12(3)8-4-6-14-7-5-8/h8H,4-7H2,1-3H3.
What are the key properties of 2-fluoro-N,2-dimethyl-N-(oxan-4-yl)propanamide?
2-fluoro-N,2-dimethyl-N-(oxan-4-yl)propanamide has a molecular weight of 203.26 g/mol, XLogP of 1.37, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N,2-dimethyl-N-(oxan-4-yl)propanamide is sourced from PubChem (CID 130165390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).