1-[4-(difluoromethyl)-5-methyl-1H-imidazol-2-yl]cyclopropan-1-ol

C8H10F2N2O — CID 84770647

IUPAC1-[4-(difluoromethyl)-5-methyl-1H-imidazol-2-yl]cyclopropan-1-ol
SMILESCc1[nH]c(C2(O)CC2)nc1C(F)F
InChIInChI=1S/C8H10F2N2O/c1-4-5(6(9)10)12-7(11-4)8(13)2-3-8/h6,13H,2-3H2,1H3,(H,11,12)
InChIKeyAIALZKBWRWXZSG-UHFFFAOYSA-N
MW188.18 g/mol
LogP1.64
Rot. Bonds2

About 1-[4-(difluoromethyl)-5-methyl-1H-imidazol-2-yl]cyclopropan-1-ol

1-[4-(difluoromethyl)-5-methyl-1H-imidazol-2-yl]cyclopropan-1-ol (PubChem CID 84770647) has the molecular formula C8H10F2N2O and a molecular weight of 188.18 g/mol. Its IUPAC name is 1-[4-(difluoromethyl)-5-methyl-1H-imidazol-2-yl]cyclopropan-1-ol.

Molecular Properties

Compound Name1-[4-(difluoromethyl)-5-methyl-1H-imidazol-2-yl]cyclopropan-1-ol
PubChem CID84770647
Molecular FormulaC8H10F2N2O
Molecular Weight188.18 g/mol
Exact Mass188.08
IUPAC Name1-[4-(difluoromethyl)-5-methyl-1H-imidazol-2-yl]cyclopropan-1-ol
SMILESCc1[nH]c(C2(O)CC2)nc1C(F)F
InChIInChI=1S/C8H10F2N2O/c1-4-5(6(9)10)12-7(11-4)8(13)2-3-8/h6,13H,2-3H2,1H3,(H,11,12)
InChIKeyAIALZKBWRWXZSG-UHFFFAOYSA-N
XLogP1.64
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.18
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(difluoromethyl)-5-methyl-1H-imidazol-2-yl]cyclopropan-1-ol?
The IUPAC name of 1-[4-(difluoromethyl)-5-methyl-1H-imidazol-2-yl]cyclopropan-1-ol (CID 84770647) is 1-[4-(difluoromethyl)-5-methyl-1H-imidazol-2-yl]cyclopropan-1-ol.
What is the SMILES notation for 1-[4-(difluoromethyl)-5-methyl-1H-imidazol-2-yl]cyclopropan-1-ol?
The canonical SMILES for 1-[4-(difluoromethyl)-5-methyl-1H-imidazol-2-yl]cyclopropan-1-ol is Cc1[nH]c(C2(O)CC2)nc1C(F)F.
What is the InChIKey of 1-[4-(difluoromethyl)-5-methyl-1H-imidazol-2-yl]cyclopropan-1-ol?
The InChIKey is AIALZKBWRWXZSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F2N2O/c1-4-5(6(9)10)12-7(11-4)8(13)2-3-8/h6,13H,2-3H2,1H3,(H,11,12).
What are the key properties of 1-[4-(difluoromethyl)-5-methyl-1H-imidazol-2-yl]cyclopropan-1-ol?
1-[4-(difluoromethyl)-5-methyl-1H-imidazol-2-yl]cyclopropan-1-ol has a molecular weight of 188.18 g/mol, XLogP of 1.64, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(difluoromethyl)-5-methyl-1H-imidazol-2-yl]cyclopropan-1-ol is sourced from PubChem (CID 84770647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).