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

C18H20N6O — CID 56862617

IUPAC3,5-dimethyl-1-[2-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]propyl]pyrazole
SMILESCc1cc(C)n(CC(C)n2ccnc2-c2ccc(-c3ccn[nH]3)o2)n1
InChIInChI=1S/C18H20N6O/c1-12-10-13(2)24(22-12)11-14(3)23-9-8-19-18(23)17-5-4-16(25-17)15-6-7-20-21-15/h4-10,14H,11H2,1-3H3,(H,20,21)
InChIKeyZDPQYICJOPEBID-UHFFFAOYSA-N
MW336.40 g/mol
LogP3.61
Rot. Bonds5

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

3,5-dimethyl-1-[2-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]propyl]pyrazole (PubChem CID 56862617) has the molecular formula C18H20N6O and a molecular weight of 336.40 g/mol. Its IUPAC name is 3,5-dimethyl-1-[2-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]propyl]pyrazole.

Molecular Properties

Compound Name3,5-dimethyl-1-[2-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]propyl]pyrazole
PubChem CID56862617
Molecular FormulaC18H20N6O
Molecular Weight336.40 g/mol
Exact Mass336.17
IUPAC Name3,5-dimethyl-1-[2-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]propyl]pyrazole
SMILESCc1cc(C)n(CC(C)n2ccnc2-c2ccc(-c3ccn[nH]3)o2)n1
InChIInChI=1S/C18H20N6O/c1-12-10-13(2)24(22-12)11-14(3)23-9-8-19-18(23)17-5-4-16(25-17)15-6-7-20-21-15/h4-10,14H,11H2,1-3H3,(H,20,21)
InChIKeyZDPQYICJOPEBID-UHFFFAOYSA-N
XLogP3.61
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 ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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

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Related Compounds

4-(Furan-2-yl)-6-[1-[[6-(methoxymethyl)-2-pyridinyl]methyl]triazol-4-yl]pyrimidin-2-amine
CID 135242138
7-(5-methyl-2-furyl)-2-(1H-pyrrol-1-yl)[1,2,4]triazolo[1,5-a]pyrimidine
CID 1471646
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-[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
5-Methyl-2-{2-[4-(5-methyl-furan-2-yl)-1H-imidazol-2-yl]-ethyl}-[1,2,4]triazolo[1,5-a]pyridine
CID 53251780
1H-Benzimidazolium, 3-(2-ethoxy-2-oxoethyl)-1-methyl-2-(5-(1-phenyl-1H-pyrazol-3-yl)-2-furanyl)-, bromide (1:1)
CID 166330
(2S)-1-[4-[[5-(furan-2-yl)-1H-pyrazol-3-yl]amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]-N-piperidin-3-ylpyrrolidine-2-carboxamide
CID 57680654
US9669029, 101 5,8-Dimethyl-2-{2-[1-methyl-4-(5-methyl-furan-2-yl)-1H-imidazol-2-yl]-ethyl}-[1,2,4]triazolo[1,5-a]pyrazine
CID 134128203
US9669029, 110 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 134128212
5-[(2-isopropyl-1H-imidazol-1-yl)methyl]-N-[(5-methyl-2-furyl)methyl]-1H-pyrazole-3-carboxamide
CID 42290712

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-1-[2-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]propyl]pyrazole?
The IUPAC name of 3,5-dimethyl-1-[2-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]propyl]pyrazole (CID 56862617) is 3,5-dimethyl-1-[2-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]propyl]pyrazole.
What is the SMILES notation for 3,5-dimethyl-1-[2-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]propyl]pyrazole?
The canonical SMILES for 3,5-dimethyl-1-[2-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]propyl]pyrazole is Cc1cc(C)n(CC(C)n2ccnc2-c2ccc(-c3ccn[nH]3)o2)n1.
What is the InChIKey of 3,5-dimethyl-1-[2-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]propyl]pyrazole?
The InChIKey is ZDPQYICJOPEBID-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N6O/c1-12-10-13(2)24(22-12)11-14(3)23-9-8-19-18(23)17-5-4-16(25-17)15-6-7-20-21-15/h4-10,14H,11H2,1-3H3,(H,20,21).
What are the key properties of 3,5-dimethyl-1-[2-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]propyl]pyrazole?
3,5-dimethyl-1-[2-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]propyl]pyrazole has a molecular weight of 336.40 g/mol, XLogP of 3.61, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-1-[2-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]propyl]pyrazole is sourced from PubChem (CID 56862617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).