2-fluoro-2-methyl-N-(3-methyloxan-4-yl)propanamide

C10H18FNO2 — CID 130173721

IUPAC2-fluoro-2-methyl-N-(3-methyloxan-4-yl)propanamide
SMILESCC1COCCC1NC(=O)C(C)(C)F
InChIInChI=1S/C10H18FNO2/c1-7-6-14-5-4-8(7)12-9(13)10(2,3)11/h7-8H,4-6H2,1-3H3,(H,12,13)
InChIKeyNVZYYCKMXXIVBG-UHFFFAOYSA-N
MW203.26 g/mol
LogP1.28
Rot. Bonds2

About 2-fluoro-2-methyl-N-(3-methyloxan-4-yl)propanamide

2-fluoro-2-methyl-N-(3-methyloxan-4-yl)propanamide (PubChem CID 130173721) has the molecular formula C10H18FNO2 and a molecular weight of 203.26 g/mol. Its IUPAC name is 2-fluoro-2-methyl-N-(3-methyloxan-4-yl)propanamide.

Molecular Properties

Compound Name2-fluoro-2-methyl-N-(3-methyloxan-4-yl)propanamide
PubChem CID130173721
Molecular FormulaC10H18FNO2
Molecular Weight203.26 g/mol
Exact Mass203.13
IUPAC Name2-fluoro-2-methyl-N-(3-methyloxan-4-yl)propanamide
SMILESCC1COCCC1NC(=O)C(C)(C)F
InChIInChI=1S/C10H18FNO2/c1-7-6-14-5-4-8(7)12-9(13)10(2,3)11/h7-8H,4-6H2,1-3H3,(H,12,13)
InChIKeyNVZYYCKMXXIVBG-UHFFFAOYSA-N
XLogP1.28
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.26
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,2-dimethyl-3-(oxan-4-ylamino)-3-oxopropanimidoyl fluoride
CID 123898684
3,3,3-trifluoro-N-(oxan-4-yl)propanamide
CID 124158954
N-(3-fluorooxan-4-yl)-2-methylpropanamide
CID 124162800
N-[2-fluoro-3-(4-methylpentoxy)butyl]-2-methylpropanamide
CID 149365164
N-[2-fluoro-3-methyl-3-(4-methylpentoxy)butyl]-2-methylpropanamide
CID 158934566
2,2-difluoro-N-[(3S,4R)-3-propan-2-yloxan-4-yl]propanamide
CID 176856756
2,2,3,3,3-pentafluoro-N-[(3S,4R)-3-propan-2-yloxan-4-yl]propanamide
CID 176856801
2,2-difluoro-N-[(3S,4R)-3-propan-2-yloxan-4-yl]acetamide
CID 176856947
N-[(3R,4S)-3-fluorooxan-4-yl]acetamide
CID 177993317
N-[(3S,4S)-3-methyloxan-4-yl]acetamide
CID 162401416
2,2,3,3-tetrafluoro-N-[1-(oxan-4-yl)ethyl]propanamide
CID 103769518
2,2,3,3,3-pentafluoro-N-[1-(oxan-4-yl)ethyl]propanamide
CID 105810851

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-2-methyl-N-(3-methyloxan-4-yl)propanamide?
The IUPAC name of 2-fluoro-2-methyl-N-(3-methyloxan-4-yl)propanamide (CID 130173721) is 2-fluoro-2-methyl-N-(3-methyloxan-4-yl)propanamide.
What is the SMILES notation for 2-fluoro-2-methyl-N-(3-methyloxan-4-yl)propanamide?
The canonical SMILES for 2-fluoro-2-methyl-N-(3-methyloxan-4-yl)propanamide is CC1COCCC1NC(=O)C(C)(C)F.
What is the InChIKey of 2-fluoro-2-methyl-N-(3-methyloxan-4-yl)propanamide?
The InChIKey is NVZYYCKMXXIVBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18FNO2/c1-7-6-14-5-4-8(7)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-(3-methyloxan-4-yl)propanamide?
2-fluoro-2-methyl-N-(3-methyloxan-4-yl)propanamide has a molecular weight of 203.26 g/mol, XLogP of 1.28, 2 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-(3-methyloxan-4-yl)propanamide is sourced from PubChem (CID 130173721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).