2-[5-(2-methylpropyl)-1H-imidazol-2-yl]propan-2-ol

C10H18N2O — CID 59843610

IUPAC2-[5-(2-methylpropyl)-1H-imidazol-2-yl]propan-2-ol
SMILESCC(C)Cc1cnc(C(C)(C)O)[nH]1
InChIInChI=1S/C10H18N2O/c1-7(2)5-8-6-11-9(12-8)10(3,4)13/h6-7,13H,5H2,1-4H3,(H,11,12)
InChIKeyFCNBKUZRLVNWNS-UHFFFAOYSA-N
MW182.27 g/mol
LogP1.84
Rot. Bonds3

About 2-[5-(2-methylpropyl)-1H-imidazol-2-yl]propan-2-ol

2-[5-(2-methylpropyl)-1H-imidazol-2-yl]propan-2-ol (PubChem CID 59843610) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is 2-[5-(2-methylpropyl)-1H-imidazol-2-yl]propan-2-ol.

Molecular Properties

Compound Name2-[5-(2-methylpropyl)-1H-imidazol-2-yl]propan-2-ol
PubChem CID59843610
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name2-[5-(2-methylpropyl)-1H-imidazol-2-yl]propan-2-ol
SMILESCC(C)Cc1cnc(C(C)(C)O)[nH]1
InChIInChI=1S/C10H18N2O/c1-7(2)5-8-6-11-9(12-8)10(3,4)13/h6-7,13H,5H2,1-4H3,(H,11,12)
InChIKeyFCNBKUZRLVNWNS-UHFFFAOYSA-N
XLogP1.84
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[5-(2-methylpropyl)-1H-imidazol-2-yl]propan-2-ol?
The IUPAC name of 2-[5-(2-methylpropyl)-1H-imidazol-2-yl]propan-2-ol (CID 59843610) is 2-[5-(2-methylpropyl)-1H-imidazol-2-yl]propan-2-ol.
What is the SMILES notation for 2-[5-(2-methylpropyl)-1H-imidazol-2-yl]propan-2-ol?
The canonical SMILES for 2-[5-(2-methylpropyl)-1H-imidazol-2-yl]propan-2-ol is CC(C)Cc1cnc(C(C)(C)O)[nH]1.
What is the InChIKey of 2-[5-(2-methylpropyl)-1H-imidazol-2-yl]propan-2-ol?
The InChIKey is FCNBKUZRLVNWNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-7(2)5-8-6-11-9(12-8)10(3,4)13/h6-7,13H,5H2,1-4H3,(H,11,12).
What are the key properties of 2-[5-(2-methylpropyl)-1H-imidazol-2-yl]propan-2-ol?
2-[5-(2-methylpropyl)-1H-imidazol-2-yl]propan-2-ol has a molecular weight of 182.27 g/mol, XLogP of 1.84, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(2-methylpropyl)-1H-imidazol-2-yl]propan-2-ol is sourced from PubChem (CID 59843610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).