(1,5-dimethylpyrazol-4-yl)-(furan-3-yl)methanone

C10H10N2O2 — CID 105099168

IUPAC(1,5-dimethylpyrazol-4-yl)-(furan-3-yl)methanone
SMILESCc1c(C(=O)c2ccoc2)cnn1C
InChIInChI=1S/C10H10N2O2/c1-7-9(5-11-12(7)2)10(13)8-3-4-14-6-8/h3-6H,1-2H3
InChIKeyWWGBPYWVIPJXQJ-UHFFFAOYSA-N
MW190.20 g/mol
LogP1.55
Rot. Bonds2

About (1,5-dimethylpyrazol-4-yl)-(furan-3-yl)methanone

(1,5-dimethylpyrazol-4-yl)-(furan-3-yl)methanone (PubChem CID 105099168) has the molecular formula C10H10N2O2 and a molecular weight of 190.20 g/mol. Its IUPAC name is (1,5-dimethylpyrazol-4-yl)-(furan-3-yl)methanone.

Molecular Properties

Compound Name(1,5-dimethylpyrazol-4-yl)-(furan-3-yl)methanone
PubChem CID105099168
Molecular FormulaC10H10N2O2
Molecular Weight190.20 g/mol
Exact Mass190.07
IUPAC Name(1,5-dimethylpyrazol-4-yl)-(furan-3-yl)methanone
SMILESCc1c(C(=O)c2ccoc2)cnn1C
InChIInChI=1S/C10H10N2O2/c1-7-9(5-11-12(7)2)10(13)8-3-4-14-6-8/h3-6H,1-2H3
InChIKeyWWGBPYWVIPJXQJ-UHFFFAOYSA-N
XLogP1.55
TPSA48.03 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.20
LogP ≤ 51.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(1,5-dimethylpyrazol-4-yl)-(2-methylpyrazol-3-yl)methanone
CID 105100479
furan-3-yl-(2-methylfuran-3-yl)methanone
CID 104789242
furan-3-yl-(2-methyltriazol-4-yl)methanone
CID 130521392
(2,3-difluorophenyl)-(1,5-dimethylpyrazol-4-yl)methanone
CID 105101862
furan-3-yl-(5-methylfuran-3-yl)methanone
CID 114971729
(1,5-dimethylpyrazol-4-yl)-(2-fluoro-5-methylphenyl)methanone
CID 105096035
5-(furan-3-yl)-1-methylpyrazole-4-carboxylic acid
CID 130711914
furan-3-yl-(4-methoxy-2-methylphenyl)methanone
CID 65313451
furan-3-yl-(3-methylfuran-2-yl)methanone
CID 104799450
furan-3-yl-(2,4,5-trimethylfuran-3-yl)methanone
CID 114971760
1,5-dimethyl-4-prop-1-en-2-ylpyrazole
CID 58550088
1,5-dimethyl-N-phenylpyrazole-4-carboxamide
CID 13031735

Frequently Asked Questions

What is the IUPAC name of (1,5-dimethylpyrazol-4-yl)-(furan-3-yl)methanone?
The IUPAC name of (1,5-dimethylpyrazol-4-yl)-(furan-3-yl)methanone (CID 105099168) is (1,5-dimethylpyrazol-4-yl)-(furan-3-yl)methanone.
What is the SMILES notation for (1,5-dimethylpyrazol-4-yl)-(furan-3-yl)methanone?
The canonical SMILES for (1,5-dimethylpyrazol-4-yl)-(furan-3-yl)methanone is Cc1c(C(=O)c2ccoc2)cnn1C.
What is the InChIKey of (1,5-dimethylpyrazol-4-yl)-(furan-3-yl)methanone?
The InChIKey is WWGBPYWVIPJXQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2/c1-7-9(5-11-12(7)2)10(13)8-3-4-14-6-8/h3-6H,1-2H3.
What are the key properties of (1,5-dimethylpyrazol-4-yl)-(furan-3-yl)methanone?
(1,5-dimethylpyrazol-4-yl)-(furan-3-yl)methanone has a molecular weight of 190.20 g/mol, XLogP of 1.55, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1,5-dimethylpyrazol-4-yl)-(furan-3-yl)methanone is sourced from PubChem (CID 105099168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).