4-amino-5,5-difluoro-N-propylpentanamide;hydrobromide

C8H17BrF2N2O — CID 20543325

IUPAC4-amino-5,5-difluoro-N-propylpentanamide;hydrobromide
SMILESBr.CCCNC(=O)CCC(N)C(F)F
InChIInChI=1S/C8H16F2N2O.BrH/c1-2-5-12-7(13)4-3-6(11)8(9)10;/h6,8H,2-5,11H2,1H3,(H,12,13);1H
InChIKeyVUWXLMMKAYHVEE-UHFFFAOYSA-N
MW275.14 g/mol
LogP1.46
Rot. Bonds6

About 4-amino-5,5-difluoro-N-propylpentanamide;hydrobromide

4-amino-5,5-difluoro-N-propylpentanamide;hydrobromide (PubChem CID 20543325) has the molecular formula C8H17BrF2N2O and a molecular weight of 275.14 g/mol. Its IUPAC name is 4-amino-5,5-difluoro-N-propylpentanamide;hydrobromide.

Molecular Properties

Compound Name4-amino-5,5-difluoro-N-propylpentanamide;hydrobromide
PubChem CID20543325
Molecular FormulaC8H17BrF2N2O
Molecular Weight275.14 g/mol
Exact Mass274.05
IUPAC Name4-amino-5,5-difluoro-N-propylpentanamide;hydrobromide
SMILESBr.CCCNC(=O)CCC(N)C(F)F
InChIInChI=1S/C8H16F2N2O.BrH/c1-2-5-12-7(13)4-3-6(11)8(9)10;/h6,8H,2-5,11H2,1H3,(H,12,13);1H
InChIKeyVUWXLMMKAYHVEE-UHFFFAOYSA-N
XLogP1.46
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.14
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-amino-5,5-difluoro-N-propylpentanamide;hydrobromide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-amino-5,5-difluoro-N-propylpentanamide;hydrobromide?
The IUPAC name of 4-amino-5,5-difluoro-N-propylpentanamide;hydrobromide (CID 20543325) is 4-amino-5,5-difluoro-N-propylpentanamide;hydrobromide.
What is the SMILES notation for 4-amino-5,5-difluoro-N-propylpentanamide;hydrobromide?
The canonical SMILES for 4-amino-5,5-difluoro-N-propylpentanamide;hydrobromide is Br.CCCNC(=O)CCC(N)C(F)F.
What is the InChIKey of 4-amino-5,5-difluoro-N-propylpentanamide;hydrobromide?
The InChIKey is VUWXLMMKAYHVEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16F2N2O.BrH/c1-2-5-12-7(13)4-3-6(11)8(9)10;/h6,8H,2-5,11H2,1H3,(H,12,13);1H.
What are the key properties of 4-amino-5,5-difluoro-N-propylpentanamide;hydrobromide?
4-amino-5,5-difluoro-N-propylpentanamide;hydrobromide has a molecular weight of 275.14 g/mol, XLogP of 1.46, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5,5-difluoro-N-propylpentanamide;hydrobromide is sourced from PubChem (CID 20543325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).