2-fluoro-4-methyl-2-propan-2-ylhexanamide

C10H20FNO — CID 139916528

IUPAC2-fluoro-4-methyl-2-propan-2-ylhexanamide
SMILESCCC(C)CC(F)(C(N)=O)C(C)C
InChIInChI=1S/C10H20FNO/c1-5-8(4)6-10(11,7(2)3)9(12)13/h7-8H,5-6H2,1-4H3,(H2,12,13)
InChIKeyFEGNTSYPFGMXCP-UHFFFAOYSA-N
MW189.27 g/mol
LogP2.27
Rot. Bonds5

About 2-fluoro-4-methyl-2-propan-2-ylhexanamide

2-fluoro-4-methyl-2-propan-2-ylhexanamide (PubChem CID 139916528) has the molecular formula C10H20FNO and a molecular weight of 189.27 g/mol. Its IUPAC name is 2-fluoro-4-methyl-2-propan-2-ylhexanamide.

Molecular Properties

Compound Name2-fluoro-4-methyl-2-propan-2-ylhexanamide
PubChem CID139916528
Molecular FormulaC10H20FNO
Molecular Weight189.27 g/mol
Exact Mass189.15
IUPAC Name2-fluoro-4-methyl-2-propan-2-ylhexanamide
SMILESCCC(C)CC(F)(C(N)=O)C(C)C
InChIInChI=1S/C10H20FNO/c1-5-8(4)6-10(11,7(2)3)9(12)13/h7-8H,5-6H2,1-4H3,(H2,12,13)
InChIKeyFEGNTSYPFGMXCP-UHFFFAOYSA-N
XLogP2.27
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.27
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Valpromide
CID 71113
Valnoctamide
CID 20140
2-Ethylhexanamide
CID 20125
4-Methyl-2-propan-2-ylpentanamide
CID 20707220
4-Methyl-2-propylpentanamide
CID 44550481
3-Methyl-2-propan-2-ylpentanamide
CID 44550482
Sec-butyl-propylacetamide
CID 44550483
Propylisopropylacetamide
CID 107977
2-Fluoro-2-propylpentanamide
CID 10130112
(2S,3S)-3-methyl-2-propylpentanamide
CID 51039482
Heptanamide, 2-ethyl-
CID 20126
2-Ethyl-5-methylhexanamide
CID 59353

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-methyl-2-propan-2-ylhexanamide?
The IUPAC name of 2-fluoro-4-methyl-2-propan-2-ylhexanamide (CID 139916528) is 2-fluoro-4-methyl-2-propan-2-ylhexanamide.
What is the SMILES notation for 2-fluoro-4-methyl-2-propan-2-ylhexanamide?
The canonical SMILES for 2-fluoro-4-methyl-2-propan-2-ylhexanamide is CCC(C)CC(F)(C(N)=O)C(C)C.
What is the InChIKey of 2-fluoro-4-methyl-2-propan-2-ylhexanamide?
The InChIKey is FEGNTSYPFGMXCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20FNO/c1-5-8(4)6-10(11,7(2)3)9(12)13/h7-8H,5-6H2,1-4H3,(H2,12,13).
What are the key properties of 2-fluoro-4-methyl-2-propan-2-ylhexanamide?
2-fluoro-4-methyl-2-propan-2-ylhexanamide has a molecular weight of 189.27 g/mol, XLogP of 2.27, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-methyl-2-propan-2-ylhexanamide is sourced from PubChem (CID 139916528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).