(2-methylfuran-3-yl)-(1H-pyrrol-2-yl)methanone

C10H9NO2 — CID 63750517

IUPAC(2-methylfuran-3-yl)-(1H-pyrrol-2-yl)methanone
SMILESCc1occc1C(=O)c1ccc[nH]1
InChIInChI=1S/C10H9NO2/c1-7-8(4-6-13-7)10(12)9-3-2-5-11-9/h2-6,11H,1H3
InChIKeyFEKPFYFOVRYDTN-UHFFFAOYSA-N
MW175.19 g/mol
LogP2.15
Rot. Bonds2

About (2-methylfuran-3-yl)-(1H-pyrrol-2-yl)methanone

(2-methylfuran-3-yl)-(1H-pyrrol-2-yl)methanone (PubChem CID 63750517) has the molecular formula C10H9NO2 and a molecular weight of 175.19 g/mol. Its IUPAC name is (2-methylfuran-3-yl)-(1H-pyrrol-2-yl)methanone.

Molecular Properties

Compound Name(2-methylfuran-3-yl)-(1H-pyrrol-2-yl)methanone
PubChem CID63750517
Molecular FormulaC10H9NO2
Molecular Weight175.19 g/mol
Exact Mass175.06
IUPAC Name(2-methylfuran-3-yl)-(1H-pyrrol-2-yl)methanone
SMILESCc1occc1C(=O)c1ccc[nH]1
InChIInChI=1S/C10H9NO2/c1-7-8(4-6-13-7)10(12)9-3-2-5-11-9/h2-6,11H,1H3
InChIKeyFEKPFYFOVRYDTN-UHFFFAOYSA-N
XLogP2.15
TPSA46.00 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-methylfuran-3-yl)-(1H-pyrrol-2-yl)methanone?
The IUPAC name of (2-methylfuran-3-yl)-(1H-pyrrol-2-yl)methanone (CID 63750517) is (2-methylfuran-3-yl)-(1H-pyrrol-2-yl)methanone.
What is the SMILES notation for (2-methylfuran-3-yl)-(1H-pyrrol-2-yl)methanone?
The canonical SMILES for (2-methylfuran-3-yl)-(1H-pyrrol-2-yl)methanone is Cc1occc1C(=O)c1ccc[nH]1.
What is the InChIKey of (2-methylfuran-3-yl)-(1H-pyrrol-2-yl)methanone?
The InChIKey is FEKPFYFOVRYDTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO2/c1-7-8(4-6-13-7)10(12)9-3-2-5-11-9/h2-6,11H,1H3.
What are the key properties of (2-methylfuran-3-yl)-(1H-pyrrol-2-yl)methanone?
(2-methylfuran-3-yl)-(1H-pyrrol-2-yl)methanone has a molecular weight of 175.19 g/mol, XLogP of 2.15, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylfuran-3-yl)-(1H-pyrrol-2-yl)methanone is sourced from PubChem (CID 63750517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).