5-amino-2-(4-aminopiperidin-1-yl)-4-ethylthieno[2,3-d]pyrimidine-6-carboxamide

C14H20N6OS — CID 24769315

IUPAC5-amino-2-(4-aminopiperidin-1-yl)-4-ethylthieno[2,3-d]pyrimidine-6-carboxamide
SMILESCCc1nc(N2CCC(N)CC2)nc2sc(C(N)=O)c(N)c12
InChIInChI=1S/C14H20N6OS/c1-2-8-9-10(16)11(12(17)21)22-13(9)19-14(18-8)20-5-3-7(15)4-6-20/h7H,2-6,15-16H2,1H3,(H2,17,21)
InChIKeyOGLKXJPHKDXJGY-UHFFFAOYSA-N
MW320.42 g/mol
LogP0.86
Rot. Bonds3

About 5-amino-2-(4-aminopiperidin-1-yl)-4-ethylthieno[2,3-d]pyrimidine-6-carboxamide

5-amino-2-(4-aminopiperidin-1-yl)-4-ethylthieno[2,3-d]pyrimidine-6-carboxamide (PubChem CID 24769315) has the molecular formula C14H20N6OS and a molecular weight of 320.42 g/mol. Its IUPAC name is 5-amino-2-(4-aminopiperidin-1-yl)-4-ethylthieno[2,3-d]pyrimidine-6-carboxamide.

Molecular Properties

Compound Name5-amino-2-(4-aminopiperidin-1-yl)-4-ethylthieno[2,3-d]pyrimidine-6-carboxamide
PubChem CID24769315
Molecular FormulaC14H20N6OS
Molecular Weight320.42 g/mol
Exact Mass320.14
IUPAC Name5-amino-2-(4-aminopiperidin-1-yl)-4-ethylthieno[2,3-d]pyrimidine-6-carboxamide
SMILESCCc1nc(N2CCC(N)CC2)nc2sc(C(N)=O)c(N)c12
InChIInChI=1S/C14H20N6OS/c1-2-8-9-10(16)11(12(17)21)22-13(9)19-14(18-8)20-5-3-7(15)4-6-20/h7H,2-6,15-16H2,1H3,(H2,17,21)
InChIKeyOGLKXJPHKDXJGY-UHFFFAOYSA-N
XLogP0.86
TPSA124.15 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.42
LogP ≤ 50.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

5-amino-4-butyl-2-(4-hydroxypiperidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
CID 24769254
3-amino-6-(4-aminopiperidin-1-yl)-4-(2,4-difluorophenyl)thieno[2,3-b]pyridine-2-carboxamide
CID 23400967
3-amino-4-(1,1-difluoropropyl)-6-(4-methylsulfanylpiperidin-1-yl)thieno[2,3-b]pyridine-2-carboxamide
CID 143596065
5-amino-4-benzylsulfanyl-2-pyrrolidin-1-ylthieno[2,3-d]pyrimidine-6-carboxamide
CID 16751678
1-[1-[4,6-bis(4-aminopiperidin-1-yl)-1,3,5-triazin-2-yl]piperidin-4-yl]propan-1-one
CID 159622008
5-amino-2-(azetidin-1-yl)-4-(3,4-dichlorophenyl)thieno[2,3-d]pyrimidine-6-carboxamide;ethane
CID 143513419
3-amino-6-(4-aminopiperidin-1-yl)-4-[3-fluoro-4-(methyliminomethyl)phenyl]thieno[2,3-b]pyridine-2-carboxamide
CID 142840255
3-amino-6-(4-aminopiperidin-1-yl)thieno[2,3-b]pyridine-2,4-dicarboxylic acid
CID 22269198
5-amino-4-(1-benzofuran-2-yl)-2-(4-hydroxypiperidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
CID 24769317
3-amino-6-[(3S)-3-aminopyrrolidin-1-yl]-4-propylthieno[2,3-b]pyridine-2-carboxylic acid
CID 23400853
3-amino-6-[(3R)-3-aminopyrrolidin-1-yl]-4-propylthieno[2,3-b]pyridine-2-carboxylic acid
CID 142776840
methyl 4-amino-2-(4-aminopiperidin-1-yl)-5-carbamoylthiophene-3-carboxylate
CID 103525672

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-(4-aminopiperidin-1-yl)-4-ethylthieno[2,3-d]pyrimidine-6-carboxamide?
The IUPAC name of 5-amino-2-(4-aminopiperidin-1-yl)-4-ethylthieno[2,3-d]pyrimidine-6-carboxamide (CID 24769315) is 5-amino-2-(4-aminopiperidin-1-yl)-4-ethylthieno[2,3-d]pyrimidine-6-carboxamide.
What is the SMILES notation for 5-amino-2-(4-aminopiperidin-1-yl)-4-ethylthieno[2,3-d]pyrimidine-6-carboxamide?
The canonical SMILES for 5-amino-2-(4-aminopiperidin-1-yl)-4-ethylthieno[2,3-d]pyrimidine-6-carboxamide is CCc1nc(N2CCC(N)CC2)nc2sc(C(N)=O)c(N)c12.
What is the InChIKey of 5-amino-2-(4-aminopiperidin-1-yl)-4-ethylthieno[2,3-d]pyrimidine-6-carboxamide?
The InChIKey is OGLKXJPHKDXJGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N6OS/c1-2-8-9-10(16)11(12(17)21)22-13(9)19-14(18-8)20-5-3-7(15)4-6-20/h7H,2-6,15-16H2,1H3,(H2,17,21).
What are the key properties of 5-amino-2-(4-aminopiperidin-1-yl)-4-ethylthieno[2,3-d]pyrimidine-6-carboxamide?
5-amino-2-(4-aminopiperidin-1-yl)-4-ethylthieno[2,3-d]pyrimidine-6-carboxamide has a molecular weight of 320.42 g/mol, XLogP of 0.86, 3 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-(4-aminopiperidin-1-yl)-4-ethylthieno[2,3-d]pyrimidine-6-carboxamide is sourced from PubChem (CID 24769315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).