1-[3-amino-5-[ethyl(2-methoxyethyl)amino]thiophen-2-yl]ethanone

C11H18N2O2S — CID 103526582

IUPAC1-[3-amino-5-[ethyl(2-methoxyethyl)amino]thiophen-2-yl]ethanone
SMILESCCN(CCOC)c1cc(N)c(C(C)=O)s1
InChIInChI=1S/C11H18N2O2S/c1-4-13(5-6-15-3)10-7-9(12)11(16-10)8(2)14/h7H,4-6,12H2,1-3H3
InChIKeyZCIPCOYPEZASON-UHFFFAOYSA-N
MW242.34 g/mol
LogP2.01
Rot. Bonds6

About 1-[3-amino-5-[ethyl(2-methoxyethyl)amino]thiophen-2-yl]ethanone

1-[3-amino-5-[ethyl(2-methoxyethyl)amino]thiophen-2-yl]ethanone (PubChem CID 103526582) has the molecular formula C11H18N2O2S and a molecular weight of 242.34 g/mol. Its IUPAC name is 1-[3-amino-5-[ethyl(2-methoxyethyl)amino]thiophen-2-yl]ethanone.

Molecular Properties

Compound Name1-[3-amino-5-[ethyl(2-methoxyethyl)amino]thiophen-2-yl]ethanone
PubChem CID103526582
Molecular FormulaC11H18N2O2S
Molecular Weight242.34 g/mol
Exact Mass242.11
IUPAC Name1-[3-amino-5-[ethyl(2-methoxyethyl)amino]thiophen-2-yl]ethanone
SMILESCCN(CCOC)c1cc(N)c(C(C)=O)s1
InChIInChI=1S/C11H18N2O2S/c1-4-13(5-6-15-3)10-7-9(12)11(16-10)8(2)14/h7H,4-6,12H2,1-3H3
InChIKeyZCIPCOYPEZASON-UHFFFAOYSA-N
XLogP2.01
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.34
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[3-amino-5-[2-methoxyethyl(methyl)amino]thiophen-2-yl]ethanone
CID 103417679
3-amino-5-[bis(2-methoxyethyl)amino]-N-methylthiophene-2-carboxamide
CID 103417671
ethyl 3-amino-5-[ethyl(propyl)amino]thiophene-2-carboxylate
CID 103421088
1-[3-amino-5-(diethylamino)thiophen-2-yl]propan-1-one
CID 103419253
1-[3-amino-5-(2-methoxyethyl)thiophen-2-yl]ethanone
CID 82376348
1-[2-[ethyl(2-methoxyethyl)amino]-4-methyl-1,3-thiazol-5-yl]ethanone
CID 62750809
1-[4-[ethyl(2-methoxyethyl)amino]phenyl]ethanone
CID 61446564
3-amino-5-[cyclopropylmethyl(ethyl)amino]thiophene-2-carboxamide
CID 103422442
4-amino-3-[ethyl(2-methoxyethyl)amino]benzamide
CID 55190704
1-[2-amino-4-[bis(2-methoxyethyl)amino]phenyl]ethanone
CID 104528435
1-[3-amino-5-[benzyl(methyl)amino]thiophen-2-yl]ethanone
CID 103420289
3-amino-5-[cyclobutylmethyl(ethyl)amino]-N-ethylthiophene-2-carboxamide
CID 107403346

Frequently Asked Questions

What is the IUPAC name of 1-[3-amino-5-[ethyl(2-methoxyethyl)amino]thiophen-2-yl]ethanone?
The IUPAC name of 1-[3-amino-5-[ethyl(2-methoxyethyl)amino]thiophen-2-yl]ethanone (CID 103526582) is 1-[3-amino-5-[ethyl(2-methoxyethyl)amino]thiophen-2-yl]ethanone.
What is the SMILES notation for 1-[3-amino-5-[ethyl(2-methoxyethyl)amino]thiophen-2-yl]ethanone?
The canonical SMILES for 1-[3-amino-5-[ethyl(2-methoxyethyl)amino]thiophen-2-yl]ethanone is CCN(CCOC)c1cc(N)c(C(C)=O)s1.
What is the InChIKey of 1-[3-amino-5-[ethyl(2-methoxyethyl)amino]thiophen-2-yl]ethanone?
The InChIKey is ZCIPCOYPEZASON-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2S/c1-4-13(5-6-15-3)10-7-9(12)11(16-10)8(2)14/h7H,4-6,12H2,1-3H3.
What are the key properties of 1-[3-amino-5-[ethyl(2-methoxyethyl)amino]thiophen-2-yl]ethanone?
1-[3-amino-5-[ethyl(2-methoxyethyl)amino]thiophen-2-yl]ethanone has a molecular weight of 242.34 g/mol, XLogP of 2.01, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-amino-5-[ethyl(2-methoxyethyl)amino]thiophen-2-yl]ethanone is sourced from PubChem (CID 103526582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).