1-(1,5-dimethylpyrazol-4-yl)-5,5,5-trifluoropentan-1-ol

C10H15F3N2O — CID 115515644

IUPAC1-(1,5-dimethylpyrazol-4-yl)-5,5,5-trifluoropentan-1-ol
SMILESCc1c(C(O)CCCC(F)(F)F)cnn1C
InChIInChI=1S/C10H15F3N2O/c1-7-8(6-14-15(7)2)9(16)4-3-5-10(11,12)13/h6,9,16H,3-5H2,1-2H3
InChIKeyIQALRDADBQIECP-UHFFFAOYSA-N
MW236.24 g/mol
LogP2.49
Rot. Bonds4

About 1-(1,5-dimethylpyrazol-4-yl)-5,5,5-trifluoropentan-1-ol

1-(1,5-dimethylpyrazol-4-yl)-5,5,5-trifluoropentan-1-ol (PubChem CID 115515644) has the molecular formula C10H15F3N2O and a molecular weight of 236.24 g/mol. Its IUPAC name is 1-(1,5-dimethylpyrazol-4-yl)-5,5,5-trifluoropentan-1-ol.

Molecular Properties

Compound Name1-(1,5-dimethylpyrazol-4-yl)-5,5,5-trifluoropentan-1-ol
PubChem CID115515644
Molecular FormulaC10H15F3N2O
Molecular Weight236.24 g/mol
Exact Mass236.11
IUPAC Name1-(1,5-dimethylpyrazol-4-yl)-5,5,5-trifluoropentan-1-ol
SMILESCc1c(C(O)CCCC(F)(F)F)cnn1C
InChIInChI=1S/C10H15F3N2O/c1-7-8(6-14-15(7)2)9(16)4-3-5-10(11,12)13/h6,9,16H,3-5H2,1-2H3
InChIKeyIQALRDADBQIECP-UHFFFAOYSA-N
XLogP2.49
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.24
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(1,5-dimethylpyrazol-4-yl)-5,5,5-trifluoropentan-1-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-methyl-4,5,6,7-tetrahydro-1H-indazol-4-ol
CID 13836898
(1R)-1-(1,4-dimethyl-1H-pyrazol-5-yl)ethan-1-ol
CID 154828527
(1S)-1-[1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]ethan-1-ol
CID 146048589
(1S)-1-(1,4-dimethyl-1H-pyrazol-5-yl)ethan-1-ol
CID 154832493
(1R)-1-(1,4-dimethyl-1H-pyrazol-3-yl)ethan-1-ol
CID 165723508
(1S)-2-ethyl-1-(4-fluoro-1-methylpyrazol-5-yl)butan-1-ol
CID 139090699
(1R)-1-(1-ethyl-3-methylpyrazol-4-yl)-2,2,2-trifluoroethanol
CID 51698679
(4,5,6,7-Tetrahydropyrazolo[1,5-a]pyridin-3-yl)methanol
CID 105429741
(E)-1-[1-methyl-4-(trifluoromethyl)pyrazol-5-yl]but-2-en-1-ol
CID 101394454
2-Ethyl-1-[1-methyl-4-(trifluoromethyl)pyrazol-5-yl]butan-1-ol
CID 102385481
[5-(Trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl]methanol
CID 90300104
2-(5-Tert-butyl-1-propan-2-ylpyrazol-4-yl)-1,1,1-trifluoropropan-2-ol
CID 126749933

Frequently Asked Questions

What is the IUPAC name of 1-(1,5-dimethylpyrazol-4-yl)-5,5,5-trifluoropentan-1-ol?
The IUPAC name of 1-(1,5-dimethylpyrazol-4-yl)-5,5,5-trifluoropentan-1-ol (CID 115515644) is 1-(1,5-dimethylpyrazol-4-yl)-5,5,5-trifluoropentan-1-ol.
What is the SMILES notation for 1-(1,5-dimethylpyrazol-4-yl)-5,5,5-trifluoropentan-1-ol?
The canonical SMILES for 1-(1,5-dimethylpyrazol-4-yl)-5,5,5-trifluoropentan-1-ol is Cc1c(C(O)CCCC(F)(F)F)cnn1C.
What is the InChIKey of 1-(1,5-dimethylpyrazol-4-yl)-5,5,5-trifluoropentan-1-ol?
The InChIKey is IQALRDADBQIECP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F3N2O/c1-7-8(6-14-15(7)2)9(16)4-3-5-10(11,12)13/h6,9,16H,3-5H2,1-2H3.
What are the key properties of 1-(1,5-dimethylpyrazol-4-yl)-5,5,5-trifluoropentan-1-ol?
1-(1,5-dimethylpyrazol-4-yl)-5,5,5-trifluoropentan-1-ol has a molecular weight of 236.24 g/mol, XLogP of 2.49, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,5-dimethylpyrazol-4-yl)-5,5,5-trifluoropentan-1-ol is sourced from PubChem (CID 115515644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).