N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]thieno[2,3-d]pyrimidin-4-amine

C15H22N4S — CID 51891886

IUPACN-[(2R)-2-methyl-3-piperidin-1-ylpropyl]thieno[2,3-d]pyrimidin-4-amine
SMILESC[C@H](CNc1ncnc2sccc12)CN1CCCCC1
InChIInChI=1S/C15H22N4S/c1-12(10-19-6-3-2-4-7-19)9-16-14-13-5-8-20-15(13)18-11-17-14/h5,8,11-12H,2-4,6-7,9-10H2,1H3,(H,16,17,18)/t12-/m1/s1
InChIKeyCDLAIRMLGPHXFP-GFCCVEGCSA-N
MW290.44 g/mol
LogP3.23
Rot. Bonds5

About N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]thieno[2,3-d]pyrimidin-4-amine

N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]thieno[2,3-d]pyrimidin-4-amine (PubChem CID 51891886) has the molecular formula C15H22N4S and a molecular weight of 290.44 g/mol. Its IUPAC name is N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]thieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-[(2R)-2-methyl-3-piperidin-1-ylpropyl]thieno[2,3-d]pyrimidin-4-amine
PubChem CID51891886
Molecular FormulaC15H22N4S
Molecular Weight290.44 g/mol
Exact Mass290.16
IUPAC NameN-[(2R)-2-methyl-3-piperidin-1-ylpropyl]thieno[2,3-d]pyrimidin-4-amine
SMILESC[C@H](CNc1ncnc2sccc12)CN1CCCCC1
InChIInChI=1S/C15H22N4S/c1-12(10-19-6-3-2-4-7-19)9-16-14-13-5-8-20-15(13)18-11-17-14/h5,8,11-12H,2-4,6-7,9-10H2,1H3,(H,16,17,18)/t12-/m1/s1
InChIKeyCDLAIRMLGPHXFP-GFCCVEGCSA-N
XLogP3.23
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 ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]thieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]thieno[2,3-d]pyrimidin-4-amine (CID 51891886) is N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]thieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]thieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]thieno[2,3-d]pyrimidin-4-amine is C[C@H](CNc1ncnc2sccc12)CN1CCCCC1.
What is the InChIKey of N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]thieno[2,3-d]pyrimidin-4-amine?
The InChIKey is CDLAIRMLGPHXFP-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H22N4S/c1-12(10-19-6-3-2-4-7-19)9-16-14-13-5-8-20-15(13)18-11-17-14/h5,8,11-12H,2-4,6-7,9-10H2,1H3,(H,16,17,18)/t12-/m1/s1.
What are the key properties of N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]thieno[2,3-d]pyrimidin-4-amine?
N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]thieno[2,3-d]pyrimidin-4-amine has a molecular weight of 290.44 g/mol, XLogP of 3.23, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]thieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 51891886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).