[1-[(4-methyl-5-propan-2-ylimidazol-1-yl)methyl]cyclopropyl]methanol

C12H20N2O — CID 176926831

IUPAC[1-[(4-methyl-5-propan-2-ylimidazol-1-yl)methyl]cyclopropyl]methanol
SMILESCc1ncn(CC2(CO)CC2)c1C(C)C
InChIInChI=1S/C12H20N2O/c1-9(2)11-10(3)13-8-14(11)6-12(7-15)4-5-12/h8-9,15H,4-7H2,1-3H3
InChIKeyREHNUXOSCQMXIG-UHFFFAOYSA-N
MW208.31 g/mol
LogP2.09
Rot. Bonds4

About [1-[(4-methyl-5-propan-2-ylimidazol-1-yl)methyl]cyclopropyl]methanol

[1-[(4-methyl-5-propan-2-ylimidazol-1-yl)methyl]cyclopropyl]methanol (PubChem CID 176926831) has the molecular formula C12H20N2O and a molecular weight of 208.31 g/mol. Its IUPAC name is [1-[(4-methyl-5-propan-2-ylimidazol-1-yl)methyl]cyclopropyl]methanol.

Molecular Properties

Compound Name[1-[(4-methyl-5-propan-2-ylimidazol-1-yl)methyl]cyclopropyl]methanol
PubChem CID176926831
Molecular FormulaC12H20N2O
Molecular Weight208.31 g/mol
Exact Mass208.16
IUPAC Name[1-[(4-methyl-5-propan-2-ylimidazol-1-yl)methyl]cyclopropyl]methanol
SMILESCc1ncn(CC2(CO)CC2)c1C(C)C
InChIInChI=1S/C12H20N2O/c1-9(2)11-10(3)13-8-14(11)6-12(7-15)4-5-12/h8-9,15H,4-7H2,1-3H3
InChIKeyREHNUXOSCQMXIG-UHFFFAOYSA-N
XLogP2.09
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [1-[(4-methyl-5-propan-2-ylimidazol-1-yl)methyl]cyclopropyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [1-[(4-methyl-5-propan-2-ylimidazol-1-yl)methyl]cyclopropyl]methanol?
The IUPAC name of [1-[(4-methyl-5-propan-2-ylimidazol-1-yl)methyl]cyclopropyl]methanol (CID 176926831) is [1-[(4-methyl-5-propan-2-ylimidazol-1-yl)methyl]cyclopropyl]methanol.
What is the SMILES notation for [1-[(4-methyl-5-propan-2-ylimidazol-1-yl)methyl]cyclopropyl]methanol?
The canonical SMILES for [1-[(4-methyl-5-propan-2-ylimidazol-1-yl)methyl]cyclopropyl]methanol is Cc1ncn(CC2(CO)CC2)c1C(C)C.
What is the InChIKey of [1-[(4-methyl-5-propan-2-ylimidazol-1-yl)methyl]cyclopropyl]methanol?
The InChIKey is REHNUXOSCQMXIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-9(2)11-10(3)13-8-14(11)6-12(7-15)4-5-12/h8-9,15H,4-7H2,1-3H3.
What are the key properties of [1-[(4-methyl-5-propan-2-ylimidazol-1-yl)methyl]cyclopropyl]methanol?
[1-[(4-methyl-5-propan-2-ylimidazol-1-yl)methyl]cyclopropyl]methanol has a molecular weight of 208.31 g/mol, XLogP of 2.09, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(4-methyl-5-propan-2-ylimidazol-1-yl)methyl]cyclopropyl]methanol is sourced from PubChem (CID 176926831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).