4-[3-(diethylamino)pyrrolidin-1-yl]-6-methylthieno[2,3-d]pyrimidin-2-amine

C15H23N5S — CID 103327595

IUPAC4-[3-(diethylamino)pyrrolidin-1-yl]-6-methylthieno[2,3-d]pyrimidin-2-amine
SMILESCCN(CC)C1CCN(c2nc(N)nc3sc(C)cc23)C1
InChIInChI=1S/C15H23N5S/c1-4-19(5-2)11-6-7-20(9-11)13-12-8-10(3)21-14(12)18-15(16)17-13/h8,11H,4-7,9H2,1-3H3,(H2,16,17,18)
InChIKeyPIHBZPQKGMUCDV-UHFFFAOYSA-N
MW305.45 g/mol
LogP2.50
Rot. Bonds4

About 4-[3-(diethylamino)pyrrolidin-1-yl]-6-methylthieno[2,3-d]pyrimidin-2-amine

4-[3-(diethylamino)pyrrolidin-1-yl]-6-methylthieno[2,3-d]pyrimidin-2-amine (PubChem CID 103327595) has the molecular formula C15H23N5S and a molecular weight of 305.45 g/mol. Its IUPAC name is 4-[3-(diethylamino)pyrrolidin-1-yl]-6-methylthieno[2,3-d]pyrimidin-2-amine.

Molecular Properties

Compound Name4-[3-(diethylamino)pyrrolidin-1-yl]-6-methylthieno[2,3-d]pyrimidin-2-amine
PubChem CID103327595
Molecular FormulaC15H23N5S
Molecular Weight305.45 g/mol
Exact Mass305.17
IUPAC Name4-[3-(diethylamino)pyrrolidin-1-yl]-6-methylthieno[2,3-d]pyrimidin-2-amine
SMILESCCN(CC)C1CCN(c2nc(N)nc3sc(C)cc23)C1
InChIInChI=1S/C15H23N5S/c1-4-19(5-2)11-6-7-20(9-11)13-12-8-10(3)21-14(12)18-15(16)17-13/h8,11H,4-7,9H2,1-3H3,(H2,16,17,18)
InChIKeyPIHBZPQKGMUCDV-UHFFFAOYSA-N
XLogP2.50
TPSA58.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.45
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[3-(diethylamino)pyrrolidin-1-yl]-6-methylthieno[2,3-d]pyrimidin-2-amine?
The IUPAC name of 4-[3-(diethylamino)pyrrolidin-1-yl]-6-methylthieno[2,3-d]pyrimidin-2-amine (CID 103327595) is 4-[3-(diethylamino)pyrrolidin-1-yl]-6-methylthieno[2,3-d]pyrimidin-2-amine.
What is the SMILES notation for 4-[3-(diethylamino)pyrrolidin-1-yl]-6-methylthieno[2,3-d]pyrimidin-2-amine?
The canonical SMILES for 4-[3-(diethylamino)pyrrolidin-1-yl]-6-methylthieno[2,3-d]pyrimidin-2-amine is CCN(CC)C1CCN(c2nc(N)nc3sc(C)cc23)C1.
What is the InChIKey of 4-[3-(diethylamino)pyrrolidin-1-yl]-6-methylthieno[2,3-d]pyrimidin-2-amine?
The InChIKey is PIHBZPQKGMUCDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5S/c1-4-19(5-2)11-6-7-20(9-11)13-12-8-10(3)21-14(12)18-15(16)17-13/h8,11H,4-7,9H2,1-3H3,(H2,16,17,18).
What are the key properties of 4-[3-(diethylamino)pyrrolidin-1-yl]-6-methylthieno[2,3-d]pyrimidin-2-amine?
4-[3-(diethylamino)pyrrolidin-1-yl]-6-methylthieno[2,3-d]pyrimidin-2-amine has a molecular weight of 305.45 g/mol, XLogP of 2.50, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(diethylamino)pyrrolidin-1-yl]-6-methylthieno[2,3-d]pyrimidin-2-amine is sourced from PubChem (CID 103327595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).