2-fluoro-N-(3-methylbutyl)acetamide

C7H14FNO — CID 10034764

IUPAC2-fluoro-N-(3-methylbutyl)acetamide
SMILESCC(C)CCNC(=O)CF
InChIInChI=1S/C7H14FNO/c1-6(2)3-4-9-7(10)5-8/h6H,3-5H2,1-2H3,(H,9,10)
InChIKeyIIYPIWJBXBELAA-UHFFFAOYSA-N
MW147.19 g/mol
LogP1.12
Rot. Bonds4

About 2-fluoro-N-(3-methylbutyl)acetamide

2-fluoro-N-(3-methylbutyl)acetamide (PubChem CID 10034764) has the molecular formula C7H14FNO and a molecular weight of 147.19 g/mol. Its IUPAC name is 2-fluoro-N-(3-methylbutyl)acetamide.

Molecular Properties

Compound Name2-fluoro-N-(3-methylbutyl)acetamide
PubChem CID10034764
Molecular FormulaC7H14FNO
Molecular Weight147.19 g/mol
Exact Mass147.11
IUPAC Name2-fluoro-N-(3-methylbutyl)acetamide
SMILESCC(C)CCNC(=O)CF
InChIInChI=1S/C7H14FNO/c1-6(2)3-4-9-7(10)5-8/h6H,3-5H2,1-2H3,(H,9,10)
InChIKeyIIYPIWJBXBELAA-UHFFFAOYSA-N
XLogP1.12
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.19
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-(3-methylbutyl)acetamide?
The IUPAC name of 2-fluoro-N-(3-methylbutyl)acetamide (CID 10034764) is 2-fluoro-N-(3-methylbutyl)acetamide.
What is the SMILES notation for 2-fluoro-N-(3-methylbutyl)acetamide?
The canonical SMILES for 2-fluoro-N-(3-methylbutyl)acetamide is CC(C)CCNC(=O)CF.
What is the InChIKey of 2-fluoro-N-(3-methylbutyl)acetamide?
The InChIKey is IIYPIWJBXBELAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14FNO/c1-6(2)3-4-9-7(10)5-8/h6H,3-5H2,1-2H3,(H,9,10).
What are the key properties of 2-fluoro-N-(3-methylbutyl)acetamide?
2-fluoro-N-(3-methylbutyl)acetamide has a molecular weight of 147.19 g/mol, XLogP of 1.12, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(3-methylbutyl)acetamide is sourced from PubChem (CID 10034764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).