1-(2-amino-6-methylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide

C13H17N5OS — CID 103323254

IUPAC1-(2-amino-6-methylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide
SMILESCc1cc2c(N3CCC(C(N)=O)CC3)nc(N)nc2s1
InChIInChI=1S/C13H17N5OS/c1-7-6-9-11(16-13(15)17-12(9)20-7)18-4-2-8(3-5-18)10(14)19/h6,8H,2-5H2,1H3,(H2,14,19)(H2,15,16,17)
InChIKeyKQRASWJHXCDCHB-UHFFFAOYSA-N
MW291.38 g/mol
LogP1.28
Rot. Bonds2

About 1-(2-amino-6-methylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide

1-(2-amino-6-methylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide (PubChem CID 103323254) has the molecular formula C13H17N5OS and a molecular weight of 291.38 g/mol. Its IUPAC name is 1-(2-amino-6-methylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-amino-6-methylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide
PubChem CID103323254
Molecular FormulaC13H17N5OS
Molecular Weight291.38 g/mol
Exact Mass291.12
IUPAC Name1-(2-amino-6-methylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide
SMILESCc1cc2c(N3CCC(C(N)=O)CC3)nc(N)nc2s1
InChIInChI=1S/C13H17N5OS/c1-7-6-9-11(16-13(15)17-12(9)20-7)18-4-2-8(3-5-18)10(14)19/h6,8H,2-5H2,1H3,(H2,14,19)(H2,15,16,17)
InChIKeyKQRASWJHXCDCHB-UHFFFAOYSA-N
XLogP1.28
TPSA98.13 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.38
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-methyl-4-(4-methylpiperidin-1-yl)thieno[2,3-d]pyrimidin-2-amine
CID 103323793
1-(2-amino-6-methylthieno[2,3-d]pyrimidin-4-yl)pyrrolidine-2-carboxamide
CID 103323978
6-methyl-4-(4-methylazepan-1-yl)thieno[2,3-d]pyrimidin-2-amine
CID 103327825
4-(4,4-dimethylpiperidin-1-yl)-6-methylthieno[2,3-d]pyrimidin-2-amine
CID 103327461
6-methyl-4-(3-propan-2-ylpyrrolidin-1-yl)thieno[2,3-d]pyrimidin-2-amine
CID 103329856
6-methyl-4-(3-propylpyrrolidin-1-yl)thieno[2,3-d]pyrimidin-2-amine
CID 103329876
4-[3-(diethylamino)pyrrolidin-1-yl]-6-methylthieno[2,3-d]pyrimidin-2-amine
CID 103327595
1-(2-hydrazinyl-6-methylthieno[2,3-d]pyrimidin-4-yl)piperidine-3-carboxamide
CID 103333914
4-(2-amino-6-methylthieno[2,3-d]pyrimidin-4-yl)-1-methyl-1,4-diazepan-2-one
CID 103330831
4-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-6-methylthieno[2,3-d]pyrimidin-2-amine
CID 103328315
6-methyl-4-(2-propan-2-ylpyrrolidin-1-yl)thieno[2,3-d]pyrimidin-2-amine
CID 103328647
1-(2-hydrazinyl-6-methylthieno[2,3-d]pyrimidin-4-yl)piperidine-2-carboxamide
CID 103332954

Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-6-methylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide?
The IUPAC name of 1-(2-amino-6-methylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide (CID 103323254) is 1-(2-amino-6-methylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(2-amino-6-methylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide?
The canonical SMILES for 1-(2-amino-6-methylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide is Cc1cc2c(N3CCC(C(N)=O)CC3)nc(N)nc2s1.
What is the InChIKey of 1-(2-amino-6-methylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide?
The InChIKey is KQRASWJHXCDCHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5OS/c1-7-6-9-11(16-13(15)17-12(9)20-7)18-4-2-8(3-5-18)10(14)19/h6,8H,2-5H2,1H3,(H2,14,19)(H2,15,16,17).
What are the key properties of 1-(2-amino-6-methylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide?
1-(2-amino-6-methylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide has a molecular weight of 291.38 g/mol, XLogP of 1.28, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-6-methylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide is sourced from PubChem (CID 103323254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).