5-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-1-methylpyrazole

C14H16N4O — CID 10083742

IUPAC5-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-1-methylpyrazole
SMILESCn1nccc1-c1ccccc1OCC1=NCCN1
InChIInChI=1S/C14H16N4O/c1-18-12(6-7-17-18)11-4-2-3-5-13(11)19-10-14-15-8-9-16-14/h2-7H,8-10H2,1H3,(H,15,16)
InChIKeyOORBCPFAQRRXTM-UHFFFAOYSA-N
MW256.31 g/mol
LogP1.47
Rot. Bonds4

About 5-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-1-methylpyrazole

5-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-1-methylpyrazole (PubChem CID 10083742) has the molecular formula C14H16N4O and a molecular weight of 256.31 g/mol. Its IUPAC name is 5-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-1-methylpyrazole.

Molecular Properties

Compound Name5-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-1-methylpyrazole
PubChem CID10083742
Molecular FormulaC14H16N4O
Molecular Weight256.31 g/mol
Exact Mass256.13
IUPAC Name5-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-1-methylpyrazole
SMILESCn1nccc1-c1ccccc1OCC1=NCCN1
InChIInChI=1S/C14H16N4O/c1-18-12(6-7-17-18)11-4-2-3-5-13(11)19-10-14-15-8-9-16-14/h2-7H,8-10H2,1H3,(H,15,16)
InChIKeyOORBCPFAQRRXTM-UHFFFAOYSA-N
XLogP1.47
TPSA51.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-1-methylpyrazole 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 5-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-1-methylpyrazole?
The IUPAC name of 5-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-1-methylpyrazole (CID 10083742) is 5-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-1-methylpyrazole.
What is the SMILES notation for 5-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-1-methylpyrazole?
The canonical SMILES for 5-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-1-methylpyrazole is Cn1nccc1-c1ccccc1OCC1=NCCN1.
What is the InChIKey of 5-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-1-methylpyrazole?
The InChIKey is OORBCPFAQRRXTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O/c1-18-12(6-7-17-18)11-4-2-3-5-13(11)19-10-14-15-8-9-16-14/h2-7H,8-10H2,1H3,(H,15,16).
What are the key properties of 5-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-1-methylpyrazole?
5-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-1-methylpyrazole has a molecular weight of 256.31 g/mol, XLogP of 1.47, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(4,5-dihydro-1H-imidazol-2-ylmethoxy)phenyl]-1-methylpyrazole is sourced from PubChem (CID 10083742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).