3-amino-4-cyclopropyl-N-ethyl-5-[2-methoxyethyl(methyl)amino]thiophene-2-carboxamide

C14H23N3O2S — CID 103417786

IUPAC3-amino-4-cyclopropyl-N-ethyl-5-[2-methoxyethyl(methyl)amino]thiophene-2-carboxamide
SMILESCCNC(=O)c1sc(N(C)CCOC)c(C2CC2)c1N
InChIInChI=1S/C14H23N3O2S/c1-4-16-13(18)12-11(15)10(9-5-6-9)14(20-12)17(2)7-8-19-3/h9H,4-8,15H2,1-3H3,(H,16,18)
InChIKeyUSHAHJHSLILTJL-UHFFFAOYSA-N
MW297.42 g/mol
LogP2.04
Rot. Bonds7

About 3-amino-4-cyclopropyl-N-ethyl-5-[2-methoxyethyl(methyl)amino]thiophene-2-carboxamide

3-amino-4-cyclopropyl-N-ethyl-5-[2-methoxyethyl(methyl)amino]thiophene-2-carboxamide (PubChem CID 103417786) has the molecular formula C14H23N3O2S and a molecular weight of 297.42 g/mol. Its IUPAC name is 3-amino-4-cyclopropyl-N-ethyl-5-[2-methoxyethyl(methyl)amino]thiophene-2-carboxamide.

Molecular Properties

Compound Name3-amino-4-cyclopropyl-N-ethyl-5-[2-methoxyethyl(methyl)amino]thiophene-2-carboxamide
PubChem CID103417786
Molecular FormulaC14H23N3O2S
Molecular Weight297.42 g/mol
Exact Mass297.15
IUPAC Name3-amino-4-cyclopropyl-N-ethyl-5-[2-methoxyethyl(methyl)amino]thiophene-2-carboxamide
SMILESCCNC(=O)c1sc(N(C)CCOC)c(C2CC2)c1N
InChIInChI=1S/C14H23N3O2S/c1-4-16-13(18)12-11(15)10(9-5-6-9)14(20-12)17(2)7-8-19-3/h9H,4-8,15H2,1-3H3,(H,16,18)
InChIKeyUSHAHJHSLILTJL-UHFFFAOYSA-N
XLogP2.04
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.42
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-4-cyclopropyl-5-[ethyl(methyl)amino]-N-methylthiophene-2-carboxamide
CID 103420939
3-amino-4-cyclopropyl-N-ethyl-5-[ethyl(2-methylpropyl)amino]thiophene-2-carboxamide
CID 103420839
1-[3-amino-5-[butyl(methyl)amino]-4-cyclopropylthiophen-2-yl]ethanone
CID 103420397
[3-amino-4-cyclopropyl-5-[methyl(propyl)amino]thiophen-2-yl]-cyclopropylmethanone
CID 103421298
3-amino-4-cyclopropyl-N,N-dimethyl-5-[methyl(3-methylbutyl)amino]thiophene-2-carboxamide
CID 103417843
3-amino-4-cyclopropyl-N-ethyl-5-(propylamino)thiophene-2-carboxamide
CID 103423180
1-[3-amino-4-cyclopropyl-5-[ethyl(methyl)amino]thiophen-2-yl]-2-methylpropan-1-one
CID 103420898
3-amino-4-methoxy-5-[2-methoxyethyl(methyl)amino]-N-prop-2-enylthiophene-2-carboxamide
CID 103417708
3-amino-4-cyano-5-[2-methoxyethyl(methyl)amino]-N-prop-2-enylthiophene-2-carboxamide
CID 103417735
3-amino-5-(azepan-1-yl)-4-cyclopropyl-N-ethylthiophene-2-carboxamide
CID 103419645
ethyl 4-amino-5-(ethylcarbamoyl)-2-[methyl(propyl)amino]thiophene-3-carboxylate
CID 103421293
3-amino-N-ethyl-5-[methyl(propyl)amino]-4-propan-2-yloxythiophene-2-carboxamide
CID 103421346

Frequently Asked Questions

What is the IUPAC name of 3-amino-4-cyclopropyl-N-ethyl-5-[2-methoxyethyl(methyl)amino]thiophene-2-carboxamide?
The IUPAC name of 3-amino-4-cyclopropyl-N-ethyl-5-[2-methoxyethyl(methyl)amino]thiophene-2-carboxamide (CID 103417786) is 3-amino-4-cyclopropyl-N-ethyl-5-[2-methoxyethyl(methyl)amino]thiophene-2-carboxamide.
What is the SMILES notation for 3-amino-4-cyclopropyl-N-ethyl-5-[2-methoxyethyl(methyl)amino]thiophene-2-carboxamide?
The canonical SMILES for 3-amino-4-cyclopropyl-N-ethyl-5-[2-methoxyethyl(methyl)amino]thiophene-2-carboxamide is CCNC(=O)c1sc(N(C)CCOC)c(C2CC2)c1N.
What is the InChIKey of 3-amino-4-cyclopropyl-N-ethyl-5-[2-methoxyethyl(methyl)amino]thiophene-2-carboxamide?
The InChIKey is USHAHJHSLILTJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2S/c1-4-16-13(18)12-11(15)10(9-5-6-9)14(20-12)17(2)7-8-19-3/h9H,4-8,15H2,1-3H3,(H,16,18).
What are the key properties of 3-amino-4-cyclopropyl-N-ethyl-5-[2-methoxyethyl(methyl)amino]thiophene-2-carboxamide?
3-amino-4-cyclopropyl-N-ethyl-5-[2-methoxyethyl(methyl)amino]thiophene-2-carboxamide has a molecular weight of 297.42 g/mol, XLogP of 2.04, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-4-cyclopropyl-N-ethyl-5-[2-methoxyethyl(methyl)amino]thiophene-2-carboxamide is sourced from PubChem (CID 103417786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).