2-amino-5,5,5-trifluoropentan-1-ol

C5H10F3NO — CID 55254151

IUPAC2-amino-5,5,5-trifluoropentan-1-ol
SMILESNC(CO)CCC(F)(F)F
InChIInChI=1S/C5H10F3NO/c6-5(7,8)2-1-4(9)3-10/h4,10H,1-3,9H2
InChIKeyLRGMRPSRNAJMBK-UHFFFAOYSA-N
MW157.13 g/mol
LogP0.65
Rot. Bonds3

About 2-amino-5,5,5-trifluoropentan-1-ol

2-amino-5,5,5-trifluoropentan-1-ol (PubChem CID 55254151) has the molecular formula C5H10F3NO and a molecular weight of 157.13 g/mol. Its IUPAC name is 2-amino-5,5,5-trifluoropentan-1-ol.

Molecular Properties

Compound Name2-amino-5,5,5-trifluoropentan-1-ol
PubChem CID55254151
Molecular FormulaC5H10F3NO
Molecular Weight157.13 g/mol
Exact Mass157.07
IUPAC Name2-amino-5,5,5-trifluoropentan-1-ol
SMILESNC(CO)CCC(F)(F)F
InChIInChI=1S/C5H10F3NO/c6-5(7,8)2-1-4(9)3-10/h4,10H,1-3,9H2
InChIKeyLRGMRPSRNAJMBK-UHFFFAOYSA-N
XLogP0.65
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.13
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-Amino-1-pentanol
CID 249017
(2R)-2-aminopentan-1-ol
CID 5324727
(2S)-2-aminopentan-1-ol
CID 6951248
2-Amino-4-fluorobutan-1-ol
CID 53878963
3-Amino-4,4,4-trifluorobutan-1-ol
CID 45358255
2-Amino-4,4,4-trifluorobutan-1-ol hydrochloride
CID 53416432
(2S)-2-amino-4,4,4-trifluorobutan-1-ol
CID 86669707
3-Amino-4,4-difluorobutan-1-ol
CID 105427236
3-Amino-1,1-difluoropentan-2-ol hydrochloride
CID 121552371
2-Amino-4,4-difluoropentan-1-ol hydrochloride
CID 139022762
(2R)-2-amino-5,5-difluoropentan-1-ol hydrochloride
CID 165986869
(2S)-2-amino-5,5-difluoropentan-1-ol hydrochloride
CID 165990692

Frequently Asked Questions

What is the IUPAC name of 2-amino-5,5,5-trifluoropentan-1-ol?
The IUPAC name of 2-amino-5,5,5-trifluoropentan-1-ol (CID 55254151) is 2-amino-5,5,5-trifluoropentan-1-ol.
What is the SMILES notation for 2-amino-5,5,5-trifluoropentan-1-ol?
The canonical SMILES for 2-amino-5,5,5-trifluoropentan-1-ol is NC(CO)CCC(F)(F)F.
What is the InChIKey of 2-amino-5,5,5-trifluoropentan-1-ol?
The InChIKey is LRGMRPSRNAJMBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10F3NO/c6-5(7,8)2-1-4(9)3-10/h4,10H,1-3,9H2.
What are the key properties of 2-amino-5,5,5-trifluoropentan-1-ol?
2-amino-5,5,5-trifluoropentan-1-ol has a molecular weight of 157.13 g/mol, XLogP of 0.65, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5,5,5-trifluoropentan-1-ol is sourced from PubChem (CID 55254151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).