(5-ethylthiophen-2-yl)-(4-methoxyphenyl)methanone

C14H14O2S — CID 43160962

IUPAC(5-ethylthiophen-2-yl)-(4-methoxyphenyl)methanone
SMILESCCc1ccc(C(=O)c2ccc(OC)cc2)s1
InChIInChI=1S/C14H14O2S/c1-3-12-8-9-13(17-12)14(15)10-4-6-11(16-2)7-5-10/h4-9H,3H2,1-2H3
InChIKeyYCPQEELYUSXIBE-UHFFFAOYSA-N
MW246.33 g/mol
LogP3.55
Rot. Bonds4

About (5-ethylthiophen-2-yl)-(4-methoxyphenyl)methanone

(5-ethylthiophen-2-yl)-(4-methoxyphenyl)methanone (PubChem CID 43160962) has the molecular formula C14H14O2S and a molecular weight of 246.33 g/mol. Its IUPAC name is (5-ethylthiophen-2-yl)-(4-methoxyphenyl)methanone.

Molecular Properties

Compound Name(5-ethylthiophen-2-yl)-(4-methoxyphenyl)methanone
PubChem CID43160962
Molecular FormulaC14H14O2S
Molecular Weight246.33 g/mol
Exact Mass246.07
IUPAC Name(5-ethylthiophen-2-yl)-(4-methoxyphenyl)methanone
SMILESCCc1ccc(C(=O)c2ccc(OC)cc2)s1
InChIInChI=1S/C14H14O2S/c1-3-12-8-9-13(17-12)14(15)10-4-6-11(16-2)7-5-10/h4-9H,3H2,1-2H3
InChIKeyYCPQEELYUSXIBE-UHFFFAOYSA-N
XLogP3.55
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.33
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(difluoromethoxy)phenyl]-(5-ethylthiophen-2-yl)methanone
CID 43160922
(5-ethylthiophen-2-yl)-(5-methoxy-3-pyridinyl)methanone
CID 115793463
2-(5-ethylthiophen-2-yl)-1-(4-methoxyphenyl)ethanone
CID 62622229
1-(5-ethylthiophen-2-yl)-2-(4-methoxyphenoxy)ethanone
CID 43612279
5-ethyl-N-[(4-methoxyphenyl)methyl]thiophene-2-carboxamide
CID 47114692
(5-ethylthiophen-2-yl)-thiophen-3-ylmethanone
CID 13356126
N-[(5-benzoylthiophen-2-yl)methyl]-2-(4-methoxyphenyl)acetamide
CID 90612901
1-(5-ethylthiophen-2-yl)-2-[(4-methoxyphenyl)methoxy]ethanone
CID 62031414
4-methoxy-N-[[5-(thiophene-3-carbonyl)thiophen-2-yl]methyl]benzamide
CID 90612517
(5-ethylthiophen-2-yl)-(1H-pyrrol-3-yl)methanone
CID 63747836
N-[5-ethyl-3-(4-methoxybenzoyl)thiophen-2-yl]-4-methoxybenzamide
CID 2814381
methyl 2-[5-(4-propan-2-ylbenzoyl)thiophen-2-yl]acetate
CID 82886030

Frequently Asked Questions

What is the IUPAC name of (5-ethylthiophen-2-yl)-(4-methoxyphenyl)methanone?
The IUPAC name of (5-ethylthiophen-2-yl)-(4-methoxyphenyl)methanone (CID 43160962) is (5-ethylthiophen-2-yl)-(4-methoxyphenyl)methanone.
What is the SMILES notation for (5-ethylthiophen-2-yl)-(4-methoxyphenyl)methanone?
The canonical SMILES for (5-ethylthiophen-2-yl)-(4-methoxyphenyl)methanone is CCc1ccc(C(=O)c2ccc(OC)cc2)s1.
What is the InChIKey of (5-ethylthiophen-2-yl)-(4-methoxyphenyl)methanone?
The InChIKey is YCPQEELYUSXIBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14O2S/c1-3-12-8-9-13(17-12)14(15)10-4-6-11(16-2)7-5-10/h4-9H,3H2,1-2H3.
What are the key properties of (5-ethylthiophen-2-yl)-(4-methoxyphenyl)methanone?
(5-ethylthiophen-2-yl)-(4-methoxyphenyl)methanone has a molecular weight of 246.33 g/mol, XLogP of 3.55, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-ethylthiophen-2-yl)-(4-methoxyphenyl)methanone is sourced from PubChem (CID 43160962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).