1-[(5-methyl-4-propan-2-ylimidazol-1-yl)methyl]cyclopropan-1-ol

C11H18N2O — CID 176927365

IUPAC1-[(5-methyl-4-propan-2-ylimidazol-1-yl)methyl]cyclopropan-1-ol
SMILESCc1c(C(C)C)ncn1CC1(O)CC1
InChIInChI=1S/C11H18N2O/c1-8(2)10-9(3)13(7-12-10)6-11(14)4-5-11/h7-8,14H,4-6H2,1-3H3
InChIKeyIREACWRMOHPDFJ-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.84
Rot. Bonds3

About 1-[(5-methyl-4-propan-2-ylimidazol-1-yl)methyl]cyclopropan-1-ol

1-[(5-methyl-4-propan-2-ylimidazol-1-yl)methyl]cyclopropan-1-ol (PubChem CID 176927365) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 1-[(5-methyl-4-propan-2-ylimidazol-1-yl)methyl]cyclopropan-1-ol.

Molecular Properties

Compound Name1-[(5-methyl-4-propan-2-ylimidazol-1-yl)methyl]cyclopropan-1-ol
PubChem CID176927365
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name1-[(5-methyl-4-propan-2-ylimidazol-1-yl)methyl]cyclopropan-1-ol
SMILESCc1c(C(C)C)ncn1CC1(O)CC1
InChIInChI=1S/C11H18N2O/c1-8(2)10-9(3)13(7-12-10)6-11(14)4-5-11/h7-8,14H,4-6H2,1-3H3
InChIKeyIREACWRMOHPDFJ-UHFFFAOYSA-N
XLogP1.84
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[(5-methyl-4-propan-2-ylimidazol-1-yl)methyl]cyclopropan-1-ol?
The IUPAC name of 1-[(5-methyl-4-propan-2-ylimidazol-1-yl)methyl]cyclopropan-1-ol (CID 176927365) is 1-[(5-methyl-4-propan-2-ylimidazol-1-yl)methyl]cyclopropan-1-ol.
What is the SMILES notation for 1-[(5-methyl-4-propan-2-ylimidazol-1-yl)methyl]cyclopropan-1-ol?
The canonical SMILES for 1-[(5-methyl-4-propan-2-ylimidazol-1-yl)methyl]cyclopropan-1-ol is Cc1c(C(C)C)ncn1CC1(O)CC1.
What is the InChIKey of 1-[(5-methyl-4-propan-2-ylimidazol-1-yl)methyl]cyclopropan-1-ol?
The InChIKey is IREACWRMOHPDFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-8(2)10-9(3)13(7-12-10)6-11(14)4-5-11/h7-8,14H,4-6H2,1-3H3.
What are the key properties of 1-[(5-methyl-4-propan-2-ylimidazol-1-yl)methyl]cyclopropan-1-ol?
1-[(5-methyl-4-propan-2-ylimidazol-1-yl)methyl]cyclopropan-1-ol has a molecular weight of 194.28 g/mol, XLogP of 1.84, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5-methyl-4-propan-2-ylimidazol-1-yl)methyl]cyclopropan-1-ol is sourced from PubChem (CID 176927365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).