6-methyl-N-(2-pyrrolidin-1-ylbutyl)thieno[2,3-d]pyrimidin-4-amine

C15H22N4S — CID 133409408

IUPAC6-methyl-N-(2-pyrrolidin-1-ylbutyl)thieno[2,3-d]pyrimidin-4-amine
SMILESCCC(CNc1ncnc2sc(C)cc12)N1CCCC1
InChIInChI=1S/C15H22N4S/c1-3-12(19-6-4-5-7-19)9-16-14-13-8-11(2)20-15(13)18-10-17-14/h8,10,12H,3-7,9H2,1-2H3,(H,16,17,18)
InChIKeyYIBAVNGBCOIQHH-UHFFFAOYSA-N
MW290.44 g/mol
LogP3.29
Rot. Bonds5

About 6-methyl-N-(2-pyrrolidin-1-ylbutyl)thieno[2,3-d]pyrimidin-4-amine

6-methyl-N-(2-pyrrolidin-1-ylbutyl)thieno[2,3-d]pyrimidin-4-amine (PubChem CID 133409408) has the molecular formula C15H22N4S and a molecular weight of 290.44 g/mol. Its IUPAC name is 6-methyl-N-(2-pyrrolidin-1-ylbutyl)thieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name6-methyl-N-(2-pyrrolidin-1-ylbutyl)thieno[2,3-d]pyrimidin-4-amine
PubChem CID133409408
Molecular FormulaC15H22N4S
Molecular Weight290.44 g/mol
Exact Mass290.16
IUPAC Name6-methyl-N-(2-pyrrolidin-1-ylbutyl)thieno[2,3-d]pyrimidin-4-amine
SMILESCCC(CNc1ncnc2sc(C)cc12)N1CCCC1
InChIInChI=1S/C15H22N4S/c1-3-12(19-6-4-5-7-19)9-16-14-13-8-11(2)20-15(13)18-10-17-14/h8,10,12H,3-7,9H2,1-2H3,(H,16,17,18)
InChIKeyYIBAVNGBCOIQHH-UHFFFAOYSA-N
XLogP3.29
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.44
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-methyl-N-(3-methyl-2-morpholin-4-ylbutyl)thieno[2,3-d]pyrimidin-4-amine
CID 133408697
2-methyl-N'-(6-methylthieno[2,3-d]pyrimidin-4-yl)propane-1,3-diamine
CID 65035565
1-(4-methylphenyl)-2-[(6-methylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol
CID 133409400
2-[(6-methylthieno[2,3-d]pyrimidin-4-yl)amino]-N-propan-2-ylacetamide
CID 39084793
N-(2-pyrrolidin-1-ylpropyl)thieno[2,3-d]pyrimidin-4-amine
CID 113222136
6-methyl-N-[2-(4-methylpiperidin-1-yl)ethyl]thieno[2,3-d]pyrimidin-4-amine
CID 133409514
1-methyl-N-(4-methyl-2-pyrrolidin-1-ylpentyl)pyrazolo[3,4-d]pyrimidin-4-amine
CID 42886101
1-(4-benzhydrylpiperazin-1-yl)-2-[(6-methylthieno[2,3-d]pyrimidin-4-yl)amino]ethanone
CID 39081494
N-[2-(chloromethyl)-2-ethylbutyl]-6-methylthieno[2,3-d]pyrimidin-4-amine
CID 106252993
6-methyl-N-[4-(4-methylpiperidin-1-yl)butyl]thieno[2,3-d]pyrimidin-4-amine
CID 133409616
6-[(6-methylthieno[2,3-d]pyrimidin-4-yl)amino]hexan-1-ol
CID 133434436
N-(1-ethylsulfonylpiperidin-4-yl)-6-methylthieno[2,3-d]pyrimidin-4-amine
CID 133408749

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(2-pyrrolidin-1-ylbutyl)thieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 6-methyl-N-(2-pyrrolidin-1-ylbutyl)thieno[2,3-d]pyrimidin-4-amine (CID 133409408) is 6-methyl-N-(2-pyrrolidin-1-ylbutyl)thieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 6-methyl-N-(2-pyrrolidin-1-ylbutyl)thieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 6-methyl-N-(2-pyrrolidin-1-ylbutyl)thieno[2,3-d]pyrimidin-4-amine is CCC(CNc1ncnc2sc(C)cc12)N1CCCC1.
What is the InChIKey of 6-methyl-N-(2-pyrrolidin-1-ylbutyl)thieno[2,3-d]pyrimidin-4-amine?
The InChIKey is YIBAVNGBCOIQHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4S/c1-3-12(19-6-4-5-7-19)9-16-14-13-8-11(2)20-15(13)18-10-17-14/h8,10,12H,3-7,9H2,1-2H3,(H,16,17,18).
What are the key properties of 6-methyl-N-(2-pyrrolidin-1-ylbutyl)thieno[2,3-d]pyrimidin-4-amine?
6-methyl-N-(2-pyrrolidin-1-ylbutyl)thieno[2,3-d]pyrimidin-4-amine has a molecular weight of 290.44 g/mol, XLogP of 3.29, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(2-pyrrolidin-1-ylbutyl)thieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 133409408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).