2-[[2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]acetamide

C11H15N5OS — CID 103324159

IUPAC2-[[2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]acetamide
SMILESCCCNc1nc(NCC(N)=O)c2ccsc2n1
InChIInChI=1S/C11H15N5OS/c1-2-4-13-11-15-9(14-6-8(12)17)7-3-5-18-10(7)16-11/h3,5H,2,4,6H2,1H3,(H2,12,17)(H2,13,14,15,16)
InChIKeyZFXWLUMQJGIBFU-UHFFFAOYSA-N
MW265.34 g/mol
LogP1.41
Rot. Bonds6

About 2-[[2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]acetamide

2-[[2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]acetamide (PubChem CID 103324159) has the molecular formula C11H15N5OS and a molecular weight of 265.34 g/mol. Its IUPAC name is 2-[[2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]acetamide.

Molecular Properties

Compound Name2-[[2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]acetamide
PubChem CID103324159
Molecular FormulaC11H15N5OS
Molecular Weight265.34 g/mol
Exact Mass265.10
IUPAC Name2-[[2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]acetamide
SMILESCCCNc1nc(NCC(N)=O)c2ccsc2n1
InChIInChI=1S/C11H15N5OS/c1-2-4-13-11-15-9(14-6-8(12)17)7-3-5-18-10(7)16-11/h3,5H,2,4,6H2,1H3,(H2,12,17)(H2,13,14,15,16)
InChIKeyZFXWLUMQJGIBFU-UHFFFAOYSA-N
XLogP1.41
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.34
LogP ≤ 51.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

3-[[2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]butanamide
CID 103330351
4-[[2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]butan-2-ol
CID 103328395
4-N-pentyl-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324258
4-N-(2-methylsulfonylethyl)-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103325366
2-[2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]sulfanylacetamide
CID 114231528
6-[[2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]hexan-1-ol
CID 107855237
4-N-[2-(2-methoxyethoxy)ethyl]-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103326766
4-N-(3-ethylpentan-3-yl)-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103328432
4-N-pentan-3-yl-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324118
N,N-dimethyl-2-[[2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]propanamide
CID 103325902
2-N-propyl-4-N-(thiophen-2-ylmethyl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103324519
4-methyl-1-[[2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]pentan-2-ol
CID 107159683

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]acetamide?
The IUPAC name of 2-[[2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]acetamide (CID 103324159) is 2-[[2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]acetamide.
What is the SMILES notation for 2-[[2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]acetamide?
The canonical SMILES for 2-[[2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]acetamide is CCCNc1nc(NCC(N)=O)c2ccsc2n1.
What is the InChIKey of 2-[[2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]acetamide?
The InChIKey is ZFXWLUMQJGIBFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5OS/c1-2-4-13-11-15-9(14-6-8(12)17)7-3-5-18-10(7)16-11/h3,5H,2,4,6H2,1H3,(H2,12,17)(H2,13,14,15,16).
What are the key properties of 2-[[2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]acetamide?
2-[[2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]acetamide has a molecular weight of 265.34 g/mol, XLogP of 1.41, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]acetamide is sourced from PubChem (CID 103324159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).