(1-methylpyrrol-2-yl)-thiophen-2-ylmethanone

C10H9NOS — CID 22481064

IUPAC(1-methylpyrrol-2-yl)-thiophen-2-ylmethanone
SMILESCn1cccc1C(=O)c1cccs1
InChIInChI=1S/C10H9NOS/c1-11-6-2-4-8(11)10(12)9-5-3-7-13-9/h2-7H,1H3
InChIKeyUEFTXYQIGDEQQP-UHFFFAOYSA-N
MW191.25 g/mol
LogP2.32
Rot. Bonds2

About (1-methylpyrrol-2-yl)-thiophen-2-ylmethanone

(1-methylpyrrol-2-yl)-thiophen-2-ylmethanone (PubChem CID 22481064) has the molecular formula C10H9NOS and a molecular weight of 191.25 g/mol. Its IUPAC name is (1-methylpyrrol-2-yl)-thiophen-2-ylmethanone.

Molecular Properties

Compound Name(1-methylpyrrol-2-yl)-thiophen-2-ylmethanone
PubChem CID22481064
Molecular FormulaC10H9NOS
Molecular Weight191.25 g/mol
Exact Mass191.04
IUPAC Name(1-methylpyrrol-2-yl)-thiophen-2-ylmethanone
SMILESCn1cccc1C(=O)c1cccs1
InChIInChI=1S/C10H9NOS/c1-11-6-2-4-8(11)10(12)9-5-3-7-13-9/h2-7H,1H3
InChIKeyUEFTXYQIGDEQQP-UHFFFAOYSA-N
XLogP2.32
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.25
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(E)-(1-methylpyrrol-2-yl)methylideneamino]thiophene-2-carboxamide
CID 6880392
Pyrrolo(2,1-d)(1,5)benzothiazepin-7(6H)-one
CID 338956
4-Dimethylamino-1-(2-oxo-2-thiophen-2-yl-ethyl)-pyridinium
CID 24746845
2,2,2-Trifluoro-1-[5-(2-pyridinyl)-2-thienyl]ethanone
CID 44541233
(E)-1-Pyridin-2-yl-3-thiophen-2-yl-propenone
CID 6244095
3-Oxo-3-[3-(1H-pyrrol-1-yl)-2-thienyl]-propanenitrile
CID 1491223
N-[[5-(hydroxycarbamoyl)thiophen-2-yl]methyl]-1-methylpyrrole-2-carboxamide
CID 73333212
2-(5-Ethyl-2-methylpyridin-1-ium-1-yl)-1-thiophen-2-ylethanone chloride
CID 16309063
N-[(E)-1-[2-(diethylamino)ethylcarbamoyl]-2-(1-methylpyrrol-2-yl)vinyl]thiophene-2-carboxamide
CID 5771244
(E)-3-(3-Methyl-thiophen-2-yl)-1-pyridin-2-yl-propenone
CID 10036789
(E)-1-Pyridin-2-yl-3-thiophen-3-yl-propenone
CID 11535860
1-(1-Thiophen-2-ylindolizin-3-yl)ethanone
CID 127029580

Frequently Asked Questions

What is the IUPAC name of (1-methylpyrrol-2-yl)-thiophen-2-ylmethanone?
The IUPAC name of (1-methylpyrrol-2-yl)-thiophen-2-ylmethanone (CID 22481064) is (1-methylpyrrol-2-yl)-thiophen-2-ylmethanone.
What is the SMILES notation for (1-methylpyrrol-2-yl)-thiophen-2-ylmethanone?
The canonical SMILES for (1-methylpyrrol-2-yl)-thiophen-2-ylmethanone is Cn1cccc1C(=O)c1cccs1.
What is the InChIKey of (1-methylpyrrol-2-yl)-thiophen-2-ylmethanone?
The InChIKey is UEFTXYQIGDEQQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NOS/c1-11-6-2-4-8(11)10(12)9-5-3-7-13-9/h2-7H,1H3.
What are the key properties of (1-methylpyrrol-2-yl)-thiophen-2-ylmethanone?
(1-methylpyrrol-2-yl)-thiophen-2-ylmethanone has a molecular weight of 191.25 g/mol, XLogP of 2.32, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylpyrrol-2-yl)-thiophen-2-ylmethanone is sourced from PubChem (CID 22481064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).