(2R)-2-amino-4,4-difluorobutan-1-ol

C4H9F2NO — CID 95378166

IUPAC(2R)-2-amino-4,4-difluorobutan-1-ol
SMILESN[C@@H](CO)CC(F)F
InChIInChI=1S/C4H9F2NO/c5-4(6)1-3(7)2-8/h3-4,8H,1-2,7H2/t3-/m1/s1
InChIKeyOYELFFAJRCUOTI-GSVOUGTGSA-N
MW125.12 g/mol
LogP-0.04
Rot. Bonds3

About (2R)-2-amino-4,4-difluorobutan-1-ol

(2R)-2-amino-4,4-difluorobutan-1-ol (PubChem CID 95378166) has the molecular formula C4H9F2NO and a molecular weight of 125.12 g/mol. Its IUPAC name is (2R)-2-amino-4,4-difluorobutan-1-ol.

Molecular Properties

Compound Name(2R)-2-amino-4,4-difluorobutan-1-ol
PubChem CID95378166
Molecular FormulaC4H9F2NO
Molecular Weight125.12 g/mol
Exact Mass125.07
IUPAC Name(2R)-2-amino-4,4-difluorobutan-1-ol
SMILESN[C@@H](CO)CC(F)F
InChIInChI=1S/C4H9F2NO/c5-4(6)1-3(7)2-8/h3-4,8H,1-2,7H2/t3-/m1/s1
InChIKeyOYELFFAJRCUOTI-GSVOUGTGSA-N
XLogP-0.04
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.12
LogP ≤ 5-0.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1,1-difluoropentan-3-amine
CID 62581791
2-amino-4-methylpentane-1,5-diol
CID 72526972
2,4,5,6-tetraaminohexan-1-ol
CID 163608286
(3R)-1,1-difluoro-4-methylpentan-3-amine
CID 58921752
(2S)-2-amino-4-fluorobutan-1-ol
CID 96551535
2-amino-4-methylhexan-1-ol;hydrochloride
CID 55253854
(3-amino-4-hydroxy-1-phosphonobutyl)phosphonic acid
CID 18757017
3-amino-1-methoxybutane-1,4-diol
CID 143333753
(2S)-2-amino-4-ethylheptan-1-ol
CID 145497284
(2S)-2-aminobutane-1,4-diol;hydrochloride
CID 91654406
(2S)-2-amino-4,4-difluorobutanoic acid;hydrochloride
CID 87593555
2-(2,2-difluoroethyl)-3,3-dimethylbutan-1-ol
CID 170403892

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-4,4-difluorobutan-1-ol?
The IUPAC name of (2R)-2-amino-4,4-difluorobutan-1-ol (CID 95378166) is (2R)-2-amino-4,4-difluorobutan-1-ol.
What is the SMILES notation for (2R)-2-amino-4,4-difluorobutan-1-ol?
The canonical SMILES for (2R)-2-amino-4,4-difluorobutan-1-ol is N[C@@H](CO)CC(F)F.
What is the InChIKey of (2R)-2-amino-4,4-difluorobutan-1-ol?
The InChIKey is OYELFFAJRCUOTI-GSVOUGTGSA-N. The full InChI is InChI=1S/C4H9F2NO/c5-4(6)1-3(7)2-8/h3-4,8H,1-2,7H2/t3-/m1/s1.
What are the key properties of (2R)-2-amino-4,4-difluorobutan-1-ol?
(2R)-2-amino-4,4-difluorobutan-1-ol has a molecular weight of 125.12 g/mol, XLogP of -0.04, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-4,4-difluorobutan-1-ol is sourced from PubChem (CID 95378166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).