2-fluoro-N,2-dimethyl-N-propylpropanamide

C8H16FNO — CID 118148465

IUPAC2-fluoro-N,2-dimethyl-N-propylpropanamide
SMILESCCCN(C)C(=O)C(C)(C)F
InChIInChI=1S/C8H16FNO/c1-5-6-10(4)7(11)8(2,3)9/h5-6H2,1-4H3
InChIKeyDIXXLBVVPYXDIB-UHFFFAOYSA-N
MW161.22 g/mol
LogP1.60
Rot. Bonds3

About 2-fluoro-N,2-dimethyl-N-propylpropanamide

2-fluoro-N,2-dimethyl-N-propylpropanamide (PubChem CID 118148465) has the molecular formula C8H16FNO and a molecular weight of 161.22 g/mol. Its IUPAC name is 2-fluoro-N,2-dimethyl-N-propylpropanamide.

Molecular Properties

Compound Name2-fluoro-N,2-dimethyl-N-propylpropanamide
PubChem CID118148465
Molecular FormulaC8H16FNO
Molecular Weight161.22 g/mol
Exact Mass161.12
IUPAC Name2-fluoro-N,2-dimethyl-N-propylpropanamide
SMILESCCCN(C)C(=O)C(C)(C)F
InChIInChI=1S/C8H16FNO/c1-5-6-10(4)7(11)8(2,3)9/h5-6H2,1-4H3
InChIKeyDIXXLBVVPYXDIB-UHFFFAOYSA-N
XLogP1.60
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.22
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N,N-Diethylpropionamide
CID 66191
N,N-Dibutylpropanamide
CID 70909
N,N-Dibutylacetamide
CID 73811
N,N-Dipropylacetamide
CID 70690
N,N-Diethylbutanamide
CID 66192
N,N-Diisopropyl-2-methylpropanamide
CID 221978
Propanamide, N,N-dipropyl-
CID 70687
Acetamide, N-butyl-N-ethyl-
CID 202537
N,N-diethyl-2,2-dimethylpropanamide
CID 4194999
2,2,3,3,4,4,4-Heptafluoro-N,N-bis(2-methylpropyl)butanamide
CID 4606680
N,N-Dibutylbutanamide
CID 243368
N,N-Diethyl-3,3,3-trifluoro-2-(trifluoromethyl)propanamide
CID 2748458

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N,2-dimethyl-N-propylpropanamide?
The IUPAC name of 2-fluoro-N,2-dimethyl-N-propylpropanamide (CID 118148465) is 2-fluoro-N,2-dimethyl-N-propylpropanamide.
What is the SMILES notation for 2-fluoro-N,2-dimethyl-N-propylpropanamide?
The canonical SMILES for 2-fluoro-N,2-dimethyl-N-propylpropanamide is CCCN(C)C(=O)C(C)(C)F.
What is the InChIKey of 2-fluoro-N,2-dimethyl-N-propylpropanamide?
The InChIKey is DIXXLBVVPYXDIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16FNO/c1-5-6-10(4)7(11)8(2,3)9/h5-6H2,1-4H3.
What are the key properties of 2-fluoro-N,2-dimethyl-N-propylpropanamide?
2-fluoro-N,2-dimethyl-N-propylpropanamide has a molecular weight of 161.22 g/mol, XLogP of 1.60, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N,2-dimethyl-N-propylpropanamide is sourced from PubChem (CID 118148465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).