1-[2-(difluoromethyl)-1H-imidazol-5-yl]cyclopropan-1-ol

C7H8F2N2O — CID 84766598

IUPAC1-[2-(difluoromethyl)-1H-imidazol-5-yl]cyclopropan-1-ol
SMILESOC1(c2cnc(C(F)F)[nH]2)CC1
InChIInChI=1S/C7H8F2N2O/c8-5(9)6-10-3-4(11-6)7(12)1-2-7/h3,5,12H,1-2H2,(H,10,11)
InChIKeyRRKISPZHFUBYDY-UHFFFAOYSA-N
MW174.15 g/mol
LogP1.33
Rot. Bonds2

About 1-[2-(difluoromethyl)-1H-imidazol-5-yl]cyclopropan-1-ol

1-[2-(difluoromethyl)-1H-imidazol-5-yl]cyclopropan-1-ol (PubChem CID 84766598) has the molecular formula C7H8F2N2O and a molecular weight of 174.15 g/mol. Its IUPAC name is 1-[2-(difluoromethyl)-1H-imidazol-5-yl]cyclopropan-1-ol.

Molecular Properties

Compound Name1-[2-(difluoromethyl)-1H-imidazol-5-yl]cyclopropan-1-ol
PubChem CID84766598
Molecular FormulaC7H8F2N2O
Molecular Weight174.15 g/mol
Exact Mass174.06
IUPAC Name1-[2-(difluoromethyl)-1H-imidazol-5-yl]cyclopropan-1-ol
SMILESOC1(c2cnc(C(F)F)[nH]2)CC1
InChIInChI=1S/C7H8F2N2O/c8-5(9)6-10-3-4(11-6)7(12)1-2-7/h3,5,12H,1-2H2,(H,10,11)
InChIKeyRRKISPZHFUBYDY-UHFFFAOYSA-N
XLogP1.33
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.15
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1h-Imidazol-4-yl)-cyclopentanol
CID 3624889
(1h-Imidazol-4-yl)propanol
CID 12344799
1-[5-(1,1-difluorobut-3-enyl)-1H-imidazol-2-yl]propan-1-ol
CID 123305415
1,1,1-trifluoro-2-(1H-imidazol-5-yl)butan-2-ol
CID 141295403
1,1,1-trifluoro-2-[5-[(Z)-2-[(Z)-2-(methylideneamino)ethenyl]but-2-enyl]-1H-imidazol-2-yl]propan-2-ol
CID 170201837
2,2,2-Trifluoro-1-(2-methyl-3H-imidazol-4-YL)-ethanol
CID 4301934
2,2,2-trifluoro-1-[2-(2,2,2-trifluoro-1-hydroxyethyl)-1H-imidazol-5-yl]ethanol
CID 13542027
1-(2-ethyl-1H-imidazol-5-yl)-2,2,2-trifluoroethanol
CID 13615331
(1S)-2,2,2-trifluoro-1-(2-methyl-1H-imidazol-5-yl)ethanol
CID 40522533
(1R)-2,2,2-trifluoro-1-(2-methyl-1H-imidazol-5-yl)ethanol
CID 40522534
1-[5-(fluoromethyl)-1H-imidazol-2-yl]cyclopropan-1-ol
CID 84763693
1-[2-(fluoromethyl)-1H-imidazol-5-yl]cyclopropan-1-ol
CID 84763694

Frequently Asked Questions

What is the IUPAC name of 1-[2-(difluoromethyl)-1H-imidazol-5-yl]cyclopropan-1-ol?
The IUPAC name of 1-[2-(difluoromethyl)-1H-imidazol-5-yl]cyclopropan-1-ol (CID 84766598) is 1-[2-(difluoromethyl)-1H-imidazol-5-yl]cyclopropan-1-ol.
What is the SMILES notation for 1-[2-(difluoromethyl)-1H-imidazol-5-yl]cyclopropan-1-ol?
The canonical SMILES for 1-[2-(difluoromethyl)-1H-imidazol-5-yl]cyclopropan-1-ol is OC1(c2cnc(C(F)F)[nH]2)CC1.
What is the InChIKey of 1-[2-(difluoromethyl)-1H-imidazol-5-yl]cyclopropan-1-ol?
The InChIKey is RRKISPZHFUBYDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F2N2O/c8-5(9)6-10-3-4(11-6)7(12)1-2-7/h3,5,12H,1-2H2,(H,10,11).
What are the key properties of 1-[2-(difluoromethyl)-1H-imidazol-5-yl]cyclopropan-1-ol?
1-[2-(difluoromethyl)-1H-imidazol-5-yl]cyclopropan-1-ol has a molecular weight of 174.15 g/mol, XLogP of 1.33, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(difluoromethyl)-1H-imidazol-5-yl]cyclopropan-1-ol is sourced from PubChem (CID 84766598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).