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

C5H10F3NO — CID 82415956

IUPAC5-amino-1,1,1-trifluoropentan-2-ol
SMILESNCCCC(O)C(F)(F)F
InChIInChI=1S/C5H10F3NO/c6-5(7,8)4(10)2-1-3-9/h4,10H,1-3,9H2
InChIKeyRXNQBCBDYNCBOV-UHFFFAOYSA-N
MW157.13 g/mol
LogP0.65
Rot. Bonds3

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

5-amino-1,1,1-trifluoropentan-2-ol (PubChem CID 82415956) has the molecular formula C5H10F3NO and a molecular weight of 157.13 g/mol. Its IUPAC name is 5-amino-1,1,1-trifluoropentan-2-ol.

Molecular Properties

Compound Name5-amino-1,1,1-trifluoropentan-2-ol
PubChem CID82415956
Molecular FormulaC5H10F3NO
Molecular Weight157.13 g/mol
Exact Mass157.07
IUPAC Name5-amino-1,1,1-trifluoropentan-2-ol
SMILESNCCCC(O)C(F)(F)F
InChIInChI=1S/C5H10F3NO/c6-5(7,8)4(10)2-1-3-9/h4,10H,1-3,9H2
InChIKeyRXNQBCBDYNCBOV-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

Analyze 5-amino-1,1,1-trifluoropentan-2-ol with MolForge

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

Launch Full Analysis

Related Compounds

1-Amino-3,3,4,4,5,5,5-heptafluoro-2-pentanol
CID 268358
1-Amino-3,3,4,4,5,5,6,6,6-nonafluorohexan-2-ol
CID 14914914
5-Aminopentan-2-ol
CID 9793714
4-Amino-1,1,1-trifluorobutan-2-ol
CID 11205810
4-Amino-1,1-difluorobutan-2-ol
CID 89933245
1-Amino-5,5,5-trifluoropentan-2-ol hydrochloride
CID 167715338
2-Pentanol, 5-amino-, (R)-
CID 10313090
1-Amino-4,4,4-trifluorobutan-2-ol
CID 17948927
(S)-1-amino-4,4,4-trifluorobutan-2-ol
CID 34178040
(S)-4-Amino-1,1,1-trifluorobutan-2-ol
CID 51886728
1-Amino-5,5,5-trifluoropentan-2-OL
CID 53415823
6-Amino-1,1,1-trifluorohexan-2-ol
CID 84731899

Frequently Asked Questions

What is the IUPAC name of 5-amino-1,1,1-trifluoropentan-2-ol?
The IUPAC name of 5-amino-1,1,1-trifluoropentan-2-ol (CID 82415956) is 5-amino-1,1,1-trifluoropentan-2-ol.
What is the SMILES notation for 5-amino-1,1,1-trifluoropentan-2-ol?
The canonical SMILES for 5-amino-1,1,1-trifluoropentan-2-ol is NCCCC(O)C(F)(F)F.
What is the InChIKey of 5-amino-1,1,1-trifluoropentan-2-ol?
The InChIKey is RXNQBCBDYNCBOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10F3NO/c6-5(7,8)4(10)2-1-3-9/h4,10H,1-3,9H2.
What are the key properties of 5-amino-1,1,1-trifluoropentan-2-ol?
5-amino-1,1,1-trifluoropentan-2-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 5-amino-1,1,1-trifluoropentan-2-ol is sourced from PubChem (CID 82415956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).