2-(2,3-difluorophenyl)butan-2-amine

C10H13F2N — CID 63988805

IUPAC2-(2,3-difluorophenyl)butan-2-amine
SMILESCCC(C)(N)c1cccc(F)c1F
InChIInChI=1S/C10H13F2N/c1-3-10(2,13)7-5-4-6-8(11)9(7)12/h4-6H,3,13H2,1-2H3
InChIKeyKSSFJDGFMVQEAT-UHFFFAOYSA-N
MW185.22 g/mol
LogP2.55
Rot. Bonds2

About 2-(2,3-difluorophenyl)butan-2-amine

2-(2,3-difluorophenyl)butan-2-amine (PubChem CID 63988805) has the molecular formula C10H13F2N and a molecular weight of 185.22 g/mol. Its IUPAC name is 2-(2,3-difluorophenyl)butan-2-amine.

Molecular Properties

Compound Name2-(2,3-difluorophenyl)butan-2-amine
PubChem CID63988805
Molecular FormulaC10H13F2N
Molecular Weight185.22 g/mol
Exact Mass185.10
IUPAC Name2-(2,3-difluorophenyl)butan-2-amine
SMILESCCC(C)(N)c1cccc(F)c1F
InChIInChI=1S/C10H13F2N/c1-3-10(2,13)7-5-4-6-8(11)9(7)12/h4-6H,3,13H2,1-2H3
InChIKeyKSSFJDGFMVQEAT-UHFFFAOYSA-N
XLogP2.55
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.22
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2,3-difluorophenyl)-1,1,1-trifluorobutan-2-ol
CID 83950267
2-(2,3-difluorophenyl)propan-2-ol
CID 10487389
1,1-difluoro-2-(2-fluorophenyl)butan-2-amine
CID 112680130
4-(2-aminobutan-2-yl)-3-fluoroaniline
CID 130134130
2-(2,3-difluorophenyl)-2,3-dimethylbutan-1-amine
CID 117048006
1-(2,3-difluorophenyl)-1-(4-methylphenyl)ethanamine
CID 63987756
(2S)-2-amino-2-(2-fluorophenyl)propan-1-ol
CID 90016000
(2S)-2-amino-2-(2-amino-3-fluorophenyl)propan-1-ol
CID 130702904
2-(2-fluoro-5-methylphenyl)butan-2-amine
CID 62791444
1-(3-bromo-2-fluorophenyl)-1-(2-fluorophenyl)propan-1-amine
CID 106644707
2-(2,3-difluorophenyl)octan-2-ol
CID 114059370
1-[bromo(difluoro)methyl]-2,3-difluorobenzene
CID 68872760

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-difluorophenyl)butan-2-amine?
The IUPAC name of 2-(2,3-difluorophenyl)butan-2-amine (CID 63988805) is 2-(2,3-difluorophenyl)butan-2-amine.
What is the SMILES notation for 2-(2,3-difluorophenyl)butan-2-amine?
The canonical SMILES for 2-(2,3-difluorophenyl)butan-2-amine is CCC(C)(N)c1cccc(F)c1F.
What is the InChIKey of 2-(2,3-difluorophenyl)butan-2-amine?
The InChIKey is KSSFJDGFMVQEAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13F2N/c1-3-10(2,13)7-5-4-6-8(11)9(7)12/h4-6H,3,13H2,1-2H3.
What are the key properties of 2-(2,3-difluorophenyl)butan-2-amine?
2-(2,3-difluorophenyl)butan-2-amine has a molecular weight of 185.22 g/mol, XLogP of 2.55, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-difluorophenyl)butan-2-amine is sourced from PubChem (CID 63988805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).