1-ethyl-3,5-dimethyl-4-[[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyrazole

C18H20N6O — CID 56876890

IUPAC1-ethyl-3,5-dimethyl-4-[[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyrazole
SMILESCCn1nc(C)c(Cn2ccnc2-c2ccc(-c3ccn[nH]3)o2)c1C
InChIInChI=1S/C18H20N6O/c1-4-24-13(3)14(12(2)22-24)11-23-10-9-19-18(23)17-6-5-16(25-17)15-7-8-20-21-15/h5-10H,4,11H2,1-3H3,(H,20,21)
InChIKeyCORRITFNTDJHBD-UHFFFAOYSA-N
MW336.40 g/mol
LogP3.41
Rot. Bonds5

About 1-ethyl-3,5-dimethyl-4-[[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyrazole

1-ethyl-3,5-dimethyl-4-[[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyrazole (PubChem CID 56876890) has the molecular formula C18H20N6O and a molecular weight of 336.40 g/mol. Its IUPAC name is 1-ethyl-3,5-dimethyl-4-[[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyrazole.

Molecular Properties

Compound Name1-ethyl-3,5-dimethyl-4-[[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyrazole
PubChem CID56876890
Molecular FormulaC18H20N6O
Molecular Weight336.40 g/mol
Exact Mass336.17
IUPAC Name1-ethyl-3,5-dimethyl-4-[[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyrazole
SMILESCCn1nc(C)c(Cn2ccnc2-c2ccc(-c3ccn[nH]3)o2)c1C
InChIInChI=1S/C18H20N6O/c1-4-24-13(3)14(12(2)22-24)11-23-10-9-19-18(23)17-6-5-16(25-17)15-7-8-20-21-15/h5-10H,4,11H2,1-3H3,(H,20,21)
InChIKeyCORRITFNTDJHBD-UHFFFAOYSA-N
XLogP3.41
TPSA77.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-ethyl-3,5-dimethyl-4-[[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyrazole with MolForge

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

Launch Full Analysis

Related Compounds

N-[4-(5-furan-2-yl-3-methyl-1h-pyrazol-4-yl)butyl]-n-methyl-7h-purin-6-amine
CID 46238526
N-{[1-(3-fluorophenyl)-3-(5-methyl-2-furyl)-1H-pyrazol-4-yl]methyl}-N-[(1-methyl-1H-imidazol-2-yl)methyl]propan-2-amine
CID 16187303
4-[5-[3-Ethyl-5-(5-methyl-2-furyl)pyrazol-1-yl]-1-[(6-methoxy-3-pyridyl)methyl]benzimidazol-2-yl]benzamide
CID 71457554
4-[5-[3-Ethyl-5-(5-methyl-2-furyl)pyrazol-1-yl]-1-(3-pyridylmethyl)benzimidazol-2-yl]benzamide
CID 71459439
4-[4-[4-(5-Methylfuran-2-yl)-3,8,10-triazatricyclo[7.3.0.02,6]dodeca-1,4,6,8,11-pentaen-3-yl]pyrazol-1-yl]butanenitrile
CID 164612264
3-[4-[4-(5-Methylfuran-2-yl)-3,8,10-triazatricyclo[7.3.0.02,6]dodeca-1,4,6,8,11-pentaen-3-yl]pyrazol-1-yl]propanenitrile
CID 164616681
US9096589, 5,7-Dimethyl-2-{2-[1-methyl-4-(5-methyl-furan-2-yl)-1H-imidazol-2-yl]-ethyl}-[1,2,4]triazolo[1,5-a]pyrimidine
CID 53250652
1H-Benzimidazolium, 3-(2-ethoxy-2-oxoethyl)-1-methyl-2-(5-(1-phenyl-1H-pyrazol-3-yl)-2-furanyl)-, bromide (1:1)
CID 166330
8-(1-ethyl-5-methyl-1H-pyrazol-4-yl)-6-{[(3S)-1-(4-furan-2-ylpyrimidin-2-yl)pyrrolidin-3-yl]oxy}-9-methyl-9H-purine
CID 90157930
5-[(2-isopropyl-1H-imidazol-1-yl)methyl]-N-[(5-methyl-2-furyl)methyl]-1H-pyrazole-3-carboxamide
CID 42290712
5-[(2-isopropyl-1H-imidazol-1-yl)methyl]-N-methyl-N-[(5-methyl-2-furyl)methyl]-1H-pyrazole-3-carboxamide
CID 42291011
5-ethyl-2-methyl-4-(4-{[5-(1H-pyrazol-3-yl)-2-furyl]methyl}piperazin-1-yl)pyrimidine
CID 50956467

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3,5-dimethyl-4-[[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyrazole?
The IUPAC name of 1-ethyl-3,5-dimethyl-4-[[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyrazole (CID 56876890) is 1-ethyl-3,5-dimethyl-4-[[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyrazole.
What is the SMILES notation for 1-ethyl-3,5-dimethyl-4-[[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyrazole?
The canonical SMILES for 1-ethyl-3,5-dimethyl-4-[[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyrazole is CCn1nc(C)c(Cn2ccnc2-c2ccc(-c3ccn[nH]3)o2)c1C.
What is the InChIKey of 1-ethyl-3,5-dimethyl-4-[[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyrazole?
The InChIKey is CORRITFNTDJHBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N6O/c1-4-24-13(3)14(12(2)22-24)11-23-10-9-19-18(23)17-6-5-16(25-17)15-7-8-20-21-15/h5-10H,4,11H2,1-3H3,(H,20,21).
What are the key properties of 1-ethyl-3,5-dimethyl-4-[[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyrazole?
1-ethyl-3,5-dimethyl-4-[[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyrazole has a molecular weight of 336.40 g/mol, XLogP of 3.41, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3,5-dimethyl-4-[[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyrazole is sourced from PubChem (CID 56876890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).