2-[(1R)-5-fluoro-4-(methoxymethyl)-2,3-dihydro-1H-inden-1-yl]-1H-imidazole

C14H15FN2O — CID 44571887

IUPAC2-[(1R)-5-fluoro-4-(methoxymethyl)-2,3-dihydro-1H-inden-1-yl]-1H-imidazole
SMILESCOCc1c(F)ccc2c1CC[C@H]2c1ncc[nH]1
InChIInChI=1S/C14H15FN2O/c1-18-8-12-10-2-3-11(14-16-6-7-17-14)9(10)4-5-13(12)15/h4-7,11H,2-3,8H2,1H3,(H,16,17)/t11-/m1/s1
InChIKeyNEABEQDKTHRKNB-LLVKDONJSA-N
MW246.28 g/mol
LogP2.77
Rot. Bonds3

About 2-[(1R)-5-fluoro-4-(methoxymethyl)-2,3-dihydro-1H-inden-1-yl]-1H-imidazole

2-[(1R)-5-fluoro-4-(methoxymethyl)-2,3-dihydro-1H-inden-1-yl]-1H-imidazole (PubChem CID 44571887) has the molecular formula C14H15FN2O and a molecular weight of 246.28 g/mol. Its IUPAC name is 2-[(1R)-5-fluoro-4-(methoxymethyl)-2,3-dihydro-1H-inden-1-yl]-1H-imidazole.

Molecular Properties

Compound Name2-[(1R)-5-fluoro-4-(methoxymethyl)-2,3-dihydro-1H-inden-1-yl]-1H-imidazole
PubChem CID44571887
Molecular FormulaC14H15FN2O
Molecular Weight246.28 g/mol
Exact Mass246.12
IUPAC Name2-[(1R)-5-fluoro-4-(methoxymethyl)-2,3-dihydro-1H-inden-1-yl]-1H-imidazole
SMILESCOCc1c(F)ccc2c1CC[C@H]2c1ncc[nH]1
InChIInChI=1S/C14H15FN2O/c1-18-8-12-10-2-3-11(14-16-6-7-17-14)9(10)4-5-13(12)15/h4-7,11H,2-3,8H2,1H3,(H,16,17)/t11-/m1/s1
InChIKeyNEABEQDKTHRKNB-LLVKDONJSA-N
XLogP2.77
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.28
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[(1R)-5-fluoro-4-(methoxymethyl)-2,3-dihydro-1H-inden-1-yl]-1H-imidazole 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 2-[(1R)-5-fluoro-4-(methoxymethyl)-2,3-dihydro-1H-inden-1-yl]-1H-imidazole?
The IUPAC name of 2-[(1R)-5-fluoro-4-(methoxymethyl)-2,3-dihydro-1H-inden-1-yl]-1H-imidazole (CID 44571887) is 2-[(1R)-5-fluoro-4-(methoxymethyl)-2,3-dihydro-1H-inden-1-yl]-1H-imidazole.
What is the SMILES notation for 2-[(1R)-5-fluoro-4-(methoxymethyl)-2,3-dihydro-1H-inden-1-yl]-1H-imidazole?
The canonical SMILES for 2-[(1R)-5-fluoro-4-(methoxymethyl)-2,3-dihydro-1H-inden-1-yl]-1H-imidazole is COCc1c(F)ccc2c1CC[C@H]2c1ncc[nH]1.
What is the InChIKey of 2-[(1R)-5-fluoro-4-(methoxymethyl)-2,3-dihydro-1H-inden-1-yl]-1H-imidazole?
The InChIKey is NEABEQDKTHRKNB-LLVKDONJSA-N. The full InChI is InChI=1S/C14H15FN2O/c1-18-8-12-10-2-3-11(14-16-6-7-17-14)9(10)4-5-13(12)15/h4-7,11H,2-3,8H2,1H3,(H,16,17)/t11-/m1/s1.
What are the key properties of 2-[(1R)-5-fluoro-4-(methoxymethyl)-2,3-dihydro-1H-inden-1-yl]-1H-imidazole?
2-[(1R)-5-fluoro-4-(methoxymethyl)-2,3-dihydro-1H-inden-1-yl]-1H-imidazole has a molecular weight of 246.28 g/mol, XLogP of 2.77, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1R)-5-fluoro-4-(methoxymethyl)-2,3-dihydro-1H-inden-1-yl]-1H-imidazole is sourced from PubChem (CID 44571887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).