2-(3-ethylcyclopentyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine

C17H25N3S — CID 65405403

IUPAC2-(3-ethylcyclopentyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine
SMILESCCCNc1nc(C2CCC(CC)C2)nc2sc(C)cc12
InChIInChI=1S/C17H25N3S/c1-4-8-18-16-14-9-11(3)21-17(14)20-15(19-16)13-7-6-12(5-2)10-13/h9,12-13H,4-8,10H2,1-3H3,(H,18,19,20)
InChIKeyYVITXRLZSZQZJF-UHFFFAOYSA-N
MW303.48 g/mol
LogP5.12
Rot. Bonds5

About 2-(3-ethylcyclopentyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine

2-(3-ethylcyclopentyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 65405403) has the molecular formula C17H25N3S and a molecular weight of 303.48 g/mol. Its IUPAC name is 2-(3-ethylcyclopentyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-(3-ethylcyclopentyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine
PubChem CID65405403
Molecular FormulaC17H25N3S
Molecular Weight303.48 g/mol
Exact Mass303.18
IUPAC Name2-(3-ethylcyclopentyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine
SMILESCCCNc1nc(C2CCC(CC)C2)nc2sc(C)cc12
InChIInChI=1S/C17H25N3S/c1-4-8-18-16-14-9-11(3)21-17(14)20-15(19-16)13-7-6-12(5-2)10-13/h9,12-13H,4-8,10H2,1-3H3,(H,18,19,20)
InChIKeyYVITXRLZSZQZJF-UHFFFAOYSA-N
XLogP5.12
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500303.48
LogP ≤ 55.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-(3-ethylcyclopentyl)-6-methylthieno[2,3-d]pyrimidin-4-yl]hydrazine
CID 65406007
6-methyl-2-(4-methylcyclohexyl)-N-propylthieno[2,3-d]pyrimidin-4-amine
CID 63616852
2-(3-ethylcyclopentyl)-6-methyl-5-propan-2-yl-N-propylpyrimidin-4-amine
CID 65406195
2-cyclohexyl-6-ethyl-N-propylthieno[2,3-d]pyrimidin-4-amine
CID 63614822
2-(2,2-dimethylpropyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine
CID 63891532
2-N,6-dimethyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324046
N-ethyl-2-(3-ethylcyclopentyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine
CID 65404241
6-ethyl-2-(oxolan-3-yl)-N-propylthieno[2,3-d]pyrimidin-4-amine
CID 65329062
6-ethyl-2-(3-ethylcyclohexyl)-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 65412798
4-N-(3-cyclopropylpropyl)-2-N-ethyl-6-methylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103330558
2-(2,2-dimethylcyclopropyl)-N-ethyl-6-methylthieno[2,3-d]pyrimidin-4-amine
CID 107925629
6-ethyl-2-(3-ethylcyclohexyl)-5-methyl-N-propylpyrimidin-4-amine
CID 65413827

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethylcyclopentyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 2-(3-ethylcyclopentyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine (CID 65405403) is 2-(3-ethylcyclopentyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 2-(3-ethylcyclopentyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 2-(3-ethylcyclopentyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine is CCCNc1nc(C2CCC(CC)C2)nc2sc(C)cc12.
What is the InChIKey of 2-(3-ethylcyclopentyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is YVITXRLZSZQZJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3S/c1-4-8-18-16-14-9-11(3)21-17(14)20-15(19-16)13-7-6-12(5-2)10-13/h9,12-13H,4-8,10H2,1-3H3,(H,18,19,20).
What are the key properties of 2-(3-ethylcyclopentyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine?
2-(3-ethylcyclopentyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 303.48 g/mol, XLogP of 5.12, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethylcyclopentyl)-6-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 65405403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).