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

C10H9NO2S — CID 81126948

IUPAC(3-methoxythiophen-2-yl)-(1H-pyrrol-3-yl)methanone
SMILESCOc1ccsc1C(=O)c1cc[nH]c1
InChIInChI=1S/C10H9NO2S/c1-13-8-3-5-14-10(8)9(12)7-2-4-11-6-7/h2-6,11H,1H3
InChIKeyREZXCJHBBYVUCZ-UHFFFAOYSA-N
MW207.25 g/mol
LogP2.32
Rot. Bonds3

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

(3-methoxythiophen-2-yl)-(1H-pyrrol-3-yl)methanone (PubChem CID 81126948) has the molecular formula C10H9NO2S and a molecular weight of 207.25 g/mol. Its IUPAC name is (3-methoxythiophen-2-yl)-(1H-pyrrol-3-yl)methanone.

Molecular Properties

Compound Name(3-methoxythiophen-2-yl)-(1H-pyrrol-3-yl)methanone
PubChem CID81126948
Molecular FormulaC10H9NO2S
Molecular Weight207.25 g/mol
Exact Mass207.04
IUPAC Name(3-methoxythiophen-2-yl)-(1H-pyrrol-3-yl)methanone
SMILESCOc1ccsc1C(=O)c1cc[nH]c1
InChIInChI=1S/C10H9NO2S/c1-13-8-3-5-14-10(8)9(12)7-2-4-11-6-7/h2-6,11H,1H3
InChIKeyREZXCJHBBYVUCZ-UHFFFAOYSA-N
XLogP2.32
TPSA42.09 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.25
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-bromophenyl)-(3-methoxythiophen-2-yl)methanone
CID 81127338
(6-methoxynaphthalen-2-yl)-(3-methoxythiophen-2-yl)methanone
CID 81121662
(3-chloro-4-methoxyphenyl)-(3-methoxythiophen-2-yl)methanone
CID 81127145
(3-methoxythiophen-2-yl)-naphthalen-2-ylmethanone
CID 81118249
(3,4-diethoxyphenyl)-(3-methoxythiophen-2-yl)methanone
CID 81121511
(4-amino-3-methylphenyl)-(3-methoxythiophen-2-yl)methanone
CID 81124722
6-(3-methoxythiophene-2-carbonyl)-3,4-dihydro-1H-quinolin-2-one
CID 81126938
2,3-dihydro-1,4-benzodioxin-6-yl-(3-methoxythiophen-2-yl)methanone
CID 81127963
potassium 3-methoxythiophene-2-carboxylate
CID 172727491
1H-indol-3-yl-(3-methoxythiophen-2-yl)methanone
CID 81127045
(4-methoxy-1-methylpyrazol-5-yl)-(3-methoxythiophen-2-yl)methanone
CID 115809517
N-carbamoyl-3-methoxythiophene-2-carboxamide
CID 81128193

Frequently Asked Questions

What is the IUPAC name of (3-methoxythiophen-2-yl)-(1H-pyrrol-3-yl)methanone?
The IUPAC name of (3-methoxythiophen-2-yl)-(1H-pyrrol-3-yl)methanone (CID 81126948) is (3-methoxythiophen-2-yl)-(1H-pyrrol-3-yl)methanone.
What is the SMILES notation for (3-methoxythiophen-2-yl)-(1H-pyrrol-3-yl)methanone?
The canonical SMILES for (3-methoxythiophen-2-yl)-(1H-pyrrol-3-yl)methanone is COc1ccsc1C(=O)c1cc[nH]c1.
What is the InChIKey of (3-methoxythiophen-2-yl)-(1H-pyrrol-3-yl)methanone?
The InChIKey is REZXCJHBBYVUCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO2S/c1-13-8-3-5-14-10(8)9(12)7-2-4-11-6-7/h2-6,11H,1H3.
What are the key properties of (3-methoxythiophen-2-yl)-(1H-pyrrol-3-yl)methanone?
(3-methoxythiophen-2-yl)-(1H-pyrrol-3-yl)methanone has a molecular weight of 207.25 g/mol, XLogP of 2.32, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methoxythiophen-2-yl)-(1H-pyrrol-3-yl)methanone is sourced from PubChem (CID 81126948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).