6-[methyl(3,3,3-trifluoropropyl)amino]hexan-3-ol

C10H20F3NO — CID 106802444

IUPAC6-[methyl(3,3,3-trifluoropropyl)amino]hexan-3-ol
SMILESCCC(O)CCCN(C)CCC(F)(F)F
InChIInChI=1S/C10H20F3NO/c1-3-9(15)5-4-7-14(2)8-6-10(11,12)13/h9,15H,3-8H2,1-2H3
InChIKeyRLFOHNUTYBLIER-UHFFFAOYSA-N
MW227.27 g/mol
LogP2.42
Rot. Bonds7

About 6-[methyl(3,3,3-trifluoropropyl)amino]hexan-3-ol

6-[methyl(3,3,3-trifluoropropyl)amino]hexan-3-ol (PubChem CID 106802444) has the molecular formula C10H20F3NO and a molecular weight of 227.27 g/mol. Its IUPAC name is 6-[methyl(3,3,3-trifluoropropyl)amino]hexan-3-ol.

Molecular Properties

Compound Name6-[methyl(3,3,3-trifluoropropyl)amino]hexan-3-ol
PubChem CID106802444
Molecular FormulaC10H20F3NO
Molecular Weight227.27 g/mol
Exact Mass227.15
IUPAC Name6-[methyl(3,3,3-trifluoropropyl)amino]hexan-3-ol
SMILESCCC(O)CCCN(C)CCC(F)(F)F
InChIInChI=1S/C10H20F3NO/c1-3-9(15)5-4-7-14(2)8-6-10(11,12)13/h9,15H,3-8H2,1-2H3
InChIKeyRLFOHNUTYBLIER-UHFFFAOYSA-N
XLogP2.42
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.27
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

nonane-3,7-diol
CID 22141483
6-[3,3-dimethylbutan-2-yl(methyl)amino]hexan-3-ol
CID 106802317
tetradecane-3,6,9,12-tetrol
CID 57081340
undecane-3,6,9-triol
CID 57025994
3-methyl-1-[methyl(4-methylhexyl)amino]pentan-3-ol
CID 137467653
6-[bis(3-methylbutyl)amino]hexan-3-ol
CID 107870897
1-(2-methylpropylamino)-3-[methyl(3,3,3-trifluoropropyl)amino]propan-2-ol
CID 115475408
9,9-dimethyldecan-3-ol
CID 156689502
2,3-dimethyl-1-[methyl(3,3,3-trifluoropropyl)amino]butan-2-ol
CID 114447669
2-[[(2R)-2,5-dihydroxyheptyl]-methylamino]acetic acid
CID 175832916
6-[(2-methoxyphenyl)methyl-methylamino]hexan-3-ol
CID 106802333
5-amino-N-methyl-N-(3,3,3-trifluoropropyl)hexanamide
CID 82851778

Frequently Asked Questions

What is the IUPAC name of 6-[methyl(3,3,3-trifluoropropyl)amino]hexan-3-ol?
The IUPAC name of 6-[methyl(3,3,3-trifluoropropyl)amino]hexan-3-ol (CID 106802444) is 6-[methyl(3,3,3-trifluoropropyl)amino]hexan-3-ol.
What is the SMILES notation for 6-[methyl(3,3,3-trifluoropropyl)amino]hexan-3-ol?
The canonical SMILES for 6-[methyl(3,3,3-trifluoropropyl)amino]hexan-3-ol is CCC(O)CCCN(C)CCC(F)(F)F.
What is the InChIKey of 6-[methyl(3,3,3-trifluoropropyl)amino]hexan-3-ol?
The InChIKey is RLFOHNUTYBLIER-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20F3NO/c1-3-9(15)5-4-7-14(2)8-6-10(11,12)13/h9,15H,3-8H2,1-2H3.
What are the key properties of 6-[methyl(3,3,3-trifluoropropyl)amino]hexan-3-ol?
6-[methyl(3,3,3-trifluoropropyl)amino]hexan-3-ol has a molecular weight of 227.27 g/mol, XLogP of 2.42, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[methyl(3,3,3-trifluoropropyl)amino]hexan-3-ol is sourced from PubChem (CID 106802444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).