3-amino-5-(4-propan-2-ylpiperidin-1-yl)thiophene-2,4-dicarboxamide

C14H22N4O2S — CID 103526786

IUPAC3-amino-5-(4-propan-2-ylpiperidin-1-yl)thiophene-2,4-dicarboxamide
SMILESCC(C)C1CCN(c2sc(C(N)=O)c(N)c2C(N)=O)CC1
InChIInChI=1S/C14H22N4O2S/c1-7(2)8-3-5-18(6-4-8)14-9(12(16)19)10(15)11(21-14)13(17)20/h7-8H,3-6,15H2,1-2H3,(H2,16,19)(H2,17,20)
InChIKeyRDZAEMNDHLVDFQ-UHFFFAOYSA-N
MW310.42 g/mol
LogP1.40
Rot. Bonds4

About 3-amino-5-(4-propan-2-ylpiperidin-1-yl)thiophene-2,4-dicarboxamide

3-amino-5-(4-propan-2-ylpiperidin-1-yl)thiophene-2,4-dicarboxamide (PubChem CID 103526786) has the molecular formula C14H22N4O2S and a molecular weight of 310.42 g/mol. Its IUPAC name is 3-amino-5-(4-propan-2-ylpiperidin-1-yl)thiophene-2,4-dicarboxamide.

Molecular Properties

Compound Name3-amino-5-(4-propan-2-ylpiperidin-1-yl)thiophene-2,4-dicarboxamide
PubChem CID103526786
Molecular FormulaC14H22N4O2S
Molecular Weight310.42 g/mol
Exact Mass310.15
IUPAC Name3-amino-5-(4-propan-2-ylpiperidin-1-yl)thiophene-2,4-dicarboxamide
SMILESCC(C)C1CCN(c2sc(C(N)=O)c(N)c2C(N)=O)CC1
InChIInChI=1S/C14H22N4O2S/c1-7(2)8-3-5-18(6-4-8)14-9(12(16)19)10(15)11(21-14)13(17)20/h7-8H,3-6,15H2,1-2H3,(H2,16,19)(H2,17,20)
InChIKeyRDZAEMNDHLVDFQ-UHFFFAOYSA-N
XLogP1.40
TPSA115.44 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.42
LogP ≤ 51.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-5-(3-propan-2-ylpyrrolidin-1-yl)thiophene-2,4-dicarboxamide
CID 103506307
3-amino-4-methylsulfanyl-5-(4-propan-2-ylazepan-1-yl)thiophene-2-carboxamide
CID 103422615
5-acetyl-4-amino-2-(4-methylpiperidin-1-yl)thiophene-3-carboxamide
CID 103418844
3-amino-4-cyano-5-(3-propan-2-ylpyrrolidin-1-yl)thiophene-2-carboxamide
CID 103506254
ethyl 4-amino-5-carbamoyl-2-(4-methylpiperidin-1-yl)thiophene-3-carboxylate
CID 103418841
methyl 4-amino-2-(4-aminopiperidin-1-yl)-5-carbamoylthiophene-3-carboxylate
CID 103525672
5-acetyl-4-amino-N-methyl-2-(3-propan-2-ylpyrrolidin-1-yl)thiophene-3-carboxamide
CID 103506286
5-acetyl-4-amino-2-piperidin-1-ylthiophene-3-carboxamide
CID 103419870
3-amino-4-N-methyl-5-(4-methylazepan-1-yl)thiophene-2,4-dicarboxamide
CID 103422098
methyl 3-amino-5-(3-aminopyrrolidin-1-yl)-4-carbamoylthiophene-2-carboxylate
CID 103525742
3-amino-5-(3-aminopyrrolidin-1-yl)-2-N-methylthiophene-2,4-dicarboxamide
CID 103525709
methyl 3-amino-5-(azepan-1-yl)-4-carbamoylthiophene-2-carboxylate
CID 103419607

Frequently Asked Questions

What is the IUPAC name of 3-amino-5-(4-propan-2-ylpiperidin-1-yl)thiophene-2,4-dicarboxamide?
The IUPAC name of 3-amino-5-(4-propan-2-ylpiperidin-1-yl)thiophene-2,4-dicarboxamide (CID 103526786) is 3-amino-5-(4-propan-2-ylpiperidin-1-yl)thiophene-2,4-dicarboxamide.
What is the SMILES notation for 3-amino-5-(4-propan-2-ylpiperidin-1-yl)thiophene-2,4-dicarboxamide?
The canonical SMILES for 3-amino-5-(4-propan-2-ylpiperidin-1-yl)thiophene-2,4-dicarboxamide is CC(C)C1CCN(c2sc(C(N)=O)c(N)c2C(N)=O)CC1.
What is the InChIKey of 3-amino-5-(4-propan-2-ylpiperidin-1-yl)thiophene-2,4-dicarboxamide?
The InChIKey is RDZAEMNDHLVDFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2S/c1-7(2)8-3-5-18(6-4-8)14-9(12(16)19)10(15)11(21-14)13(17)20/h7-8H,3-6,15H2,1-2H3,(H2,16,19)(H2,17,20).
What are the key properties of 3-amino-5-(4-propan-2-ylpiperidin-1-yl)thiophene-2,4-dicarboxamide?
3-amino-5-(4-propan-2-ylpiperidin-1-yl)thiophene-2,4-dicarboxamide has a molecular weight of 310.42 g/mol, XLogP of 1.40, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-5-(4-propan-2-ylpiperidin-1-yl)thiophene-2,4-dicarboxamide is sourced from PubChem (CID 103526786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).