1-(furan-2-yl)-2-(1-methylpyrazol-4-yl)ethanone

C10H10N2O2 — CID 62717295

IUPAC1-(furan-2-yl)-2-(1-methylpyrazol-4-yl)ethanone
SMILESCn1cc(CC(=O)c2ccco2)cn1
InChIInChI=1S/C10H10N2O2/c1-12-7-8(6-11-12)5-9(13)10-3-2-4-14-10/h2-4,6-7H,5H2,1H3
InChIKeyRHANFPAHMXIGBL-UHFFFAOYSA-N
MW190.20 g/mol
LogP1.44
Rot. Bonds3

About 1-(furan-2-yl)-2-(1-methylpyrazol-4-yl)ethanone

1-(furan-2-yl)-2-(1-methylpyrazol-4-yl)ethanone (PubChem CID 62717295) has the molecular formula C10H10N2O2 and a molecular weight of 190.20 g/mol. Its IUPAC name is 1-(furan-2-yl)-2-(1-methylpyrazol-4-yl)ethanone.

Molecular Properties

Compound Name1-(furan-2-yl)-2-(1-methylpyrazol-4-yl)ethanone
PubChem CID62717295
Molecular FormulaC10H10N2O2
Molecular Weight190.20 g/mol
Exact Mass190.07
IUPAC Name1-(furan-2-yl)-2-(1-methylpyrazol-4-yl)ethanone
SMILESCn1cc(CC(=O)c2ccco2)cn1
InChIInChI=1S/C10H10N2O2/c1-12-7-8(6-11-12)5-9(13)10-3-2-4-14-10/h2-4,6-7H,5H2,1H3
InChIKeyRHANFPAHMXIGBL-UHFFFAOYSA-N
XLogP1.44
TPSA48.03 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.20
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(5-bromofuran-2-yl)-2-(1-methylpyrazol-4-yl)ethanone
CID 114965218
[(3aR,6aS)-1-[(1-methylpyrazol-4-yl)methyl]-2,3,3a,5,6,6a-hexahydropyrrolo[3,2-b]pyrrol-4-yl]-(furan-2-yl)methanone
CID 97459164
1-(1,3-dimethylpyrazol-4-yl)-2-(1-methylpyrazol-4-yl)ethanone
CID 102802676
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-methylpyrazol-4-yl)ethanone
CID 114965179
1-(1-methylindazol-3-yl)-2-(1-methylpyrazol-4-yl)ethanone
CID 103124107
1-(3-bromo-2-chlorophenyl)-2-(1-methylpyrazol-4-yl)ethanone
CID 114965321
N-[(1S)-1-(1-methylpyrazol-4-yl)ethyl]furan-2-carboxamide
CID 35276451
4-(furan-2-carbonyl)-N'-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]piperazine-1-carboximidamide
CID 111167439
1-(2,6-dimethyl-3-pyridinyl)-2-(1-methylpyrazol-4-yl)ethanone
CID 105084447
2-(4-chlorophenyl)-1-(furan-2-yl)ethanone
CID 11096153
3-(furan-2-yl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide
CID 134037132
1-hydroxy-3-(1-methylpyrazol-4-yl)-1-phenylpropan-2-one
CID 103458024

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)-2-(1-methylpyrazol-4-yl)ethanone?
The IUPAC name of 1-(furan-2-yl)-2-(1-methylpyrazol-4-yl)ethanone (CID 62717295) is 1-(furan-2-yl)-2-(1-methylpyrazol-4-yl)ethanone.
What is the SMILES notation for 1-(furan-2-yl)-2-(1-methylpyrazol-4-yl)ethanone?
The canonical SMILES for 1-(furan-2-yl)-2-(1-methylpyrazol-4-yl)ethanone is Cn1cc(CC(=O)c2ccco2)cn1.
What is the InChIKey of 1-(furan-2-yl)-2-(1-methylpyrazol-4-yl)ethanone?
The InChIKey is RHANFPAHMXIGBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2/c1-12-7-8(6-11-12)5-9(13)10-3-2-4-14-10/h2-4,6-7H,5H2,1H3.
What are the key properties of 1-(furan-2-yl)-2-(1-methylpyrazol-4-yl)ethanone?
1-(furan-2-yl)-2-(1-methylpyrazol-4-yl)ethanone has a molecular weight of 190.20 g/mol, XLogP of 1.44, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)-2-(1-methylpyrazol-4-yl)ethanone is sourced from PubChem (CID 62717295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).