6-methyl-4-(2-propan-2-ylpyrrolidin-1-yl)thieno[2,3-d]pyrimidin-2-amine

C14H20N4S — CID 103328647

IUPAC6-methyl-4-(2-propan-2-ylpyrrolidin-1-yl)thieno[2,3-d]pyrimidin-2-amine
SMILESCc1cc2c(N3CCCC3C(C)C)nc(N)nc2s1
InChIInChI=1S/C14H20N4S/c1-8(2)11-5-4-6-18(11)12-10-7-9(3)19-13(10)17-14(15)16-12/h7-8,11H,4-6H2,1-3H3,(H2,15,16,17)
InChIKeyYEMRQFDSVJQYDV-UHFFFAOYSA-N
MW276.41 g/mol
LogP3.21
Rot. Bonds2

About 6-methyl-4-(2-propan-2-ylpyrrolidin-1-yl)thieno[2,3-d]pyrimidin-2-amine

6-methyl-4-(2-propan-2-ylpyrrolidin-1-yl)thieno[2,3-d]pyrimidin-2-amine (PubChem CID 103328647) has the molecular formula C14H20N4S and a molecular weight of 276.41 g/mol. Its IUPAC name is 6-methyl-4-(2-propan-2-ylpyrrolidin-1-yl)thieno[2,3-d]pyrimidin-2-amine.

Molecular Properties

Compound Name6-methyl-4-(2-propan-2-ylpyrrolidin-1-yl)thieno[2,3-d]pyrimidin-2-amine
PubChem CID103328647
Molecular FormulaC14H20N4S
Molecular Weight276.41 g/mol
Exact Mass276.14
IUPAC Name6-methyl-4-(2-propan-2-ylpyrrolidin-1-yl)thieno[2,3-d]pyrimidin-2-amine
SMILESCc1cc2c(N3CCCC3C(C)C)nc(N)nc2s1
InChIInChI=1S/C14H20N4S/c1-8(2)11-5-4-6-18(11)12-10-7-9(3)19-13(10)17-14(15)16-12/h7-8,11H,4-6H2,1-3H3,(H2,15,16,17)
InChIKeyYEMRQFDSVJQYDV-UHFFFAOYSA-N
XLogP3.21
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.41
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-(2-propan-2-ylpyrrolidin-1-yl)thieno[2,3-d]pyrimidin-2-amine?
The IUPAC name of 6-methyl-4-(2-propan-2-ylpyrrolidin-1-yl)thieno[2,3-d]pyrimidin-2-amine (CID 103328647) is 6-methyl-4-(2-propan-2-ylpyrrolidin-1-yl)thieno[2,3-d]pyrimidin-2-amine.
What is the SMILES notation for 6-methyl-4-(2-propan-2-ylpyrrolidin-1-yl)thieno[2,3-d]pyrimidin-2-amine?
The canonical SMILES for 6-methyl-4-(2-propan-2-ylpyrrolidin-1-yl)thieno[2,3-d]pyrimidin-2-amine is Cc1cc2c(N3CCCC3C(C)C)nc(N)nc2s1.
What is the InChIKey of 6-methyl-4-(2-propan-2-ylpyrrolidin-1-yl)thieno[2,3-d]pyrimidin-2-amine?
The InChIKey is YEMRQFDSVJQYDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4S/c1-8(2)11-5-4-6-18(11)12-10-7-9(3)19-13(10)17-14(15)16-12/h7-8,11H,4-6H2,1-3H3,(H2,15,16,17).
What are the key properties of 6-methyl-4-(2-propan-2-ylpyrrolidin-1-yl)thieno[2,3-d]pyrimidin-2-amine?
6-methyl-4-(2-propan-2-ylpyrrolidin-1-yl)thieno[2,3-d]pyrimidin-2-amine has a molecular weight of 276.41 g/mol, XLogP of 3.21, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-(2-propan-2-ylpyrrolidin-1-yl)thieno[2,3-d]pyrimidin-2-amine is sourced from PubChem (CID 103328647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).