5,6-dimethyl-N-(1-piperidin-3-ylethyl)thieno[2,3-d]pyrimidin-4-amine

C15H22N4S — CID 62046212

IUPAC5,6-dimethyl-N-(1-piperidin-3-ylethyl)thieno[2,3-d]pyrimidin-4-amine
SMILESCc1sc2ncnc(NC(C)C3CCCNC3)c2c1C
InChIInChI=1S/C15H22N4S/c1-9-11(3)20-15-13(9)14(17-8-18-15)19-10(2)12-5-4-6-16-7-12/h8,10,12,16H,4-7H2,1-3H3,(H,17,18,19)
InChIKeyPJPMJJDWAURSGK-UHFFFAOYSA-N
MW290.44 g/mol
LogP3.11
Rot. Bonds3

About 5,6-dimethyl-N-(1-piperidin-3-ylethyl)thieno[2,3-d]pyrimidin-4-amine

5,6-dimethyl-N-(1-piperidin-3-ylethyl)thieno[2,3-d]pyrimidin-4-amine (PubChem CID 62046212) has the molecular formula C15H22N4S and a molecular weight of 290.44 g/mol. Its IUPAC name is 5,6-dimethyl-N-(1-piperidin-3-ylethyl)thieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name5,6-dimethyl-N-(1-piperidin-3-ylethyl)thieno[2,3-d]pyrimidin-4-amine
PubChem CID62046212
Molecular FormulaC15H22N4S
Molecular Weight290.44 g/mol
Exact Mass290.16
IUPAC Name5,6-dimethyl-N-(1-piperidin-3-ylethyl)thieno[2,3-d]pyrimidin-4-amine
SMILESCc1sc2ncnc(NC(C)C3CCCNC3)c2c1C
InChIInChI=1S/C15H22N4S/c1-9-11(3)20-15-13(9)14(17-8-18-15)19-10(2)12-5-4-6-16-7-12/h8,10,12,16H,4-7H2,1-3H3,(H,17,18,19)
InChIKeyPJPMJJDWAURSGK-UHFFFAOYSA-N
XLogP3.11
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.44
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-cyclohexylethyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine
CID 63540281
N-cyclohexyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine
CID 712429
5-methyl-N-(1-piperidin-3-ylethyl)pyridin-2-amine
CID 62045704
4-N-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)cyclohexane-1,4-diamine
CID 62318881
3-N-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)butane-1,3-diamine
CID 83180101
(2R)-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]-3-methylbutanoic acid
CID 1076131
5,6-dimethyl-N-[(1R)-1-phenylethyl]thieno[2,3-d]pyrimidin-4-amine
CID 731283
3-(1-piperidin-3-ylethylamino)pyrazine-2-carbonitrile
CID 55104640
2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]-1-pyrrolidin-1-ylpropan-1-one
CID 115574255
N-(cyclopropylmethyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine
CID 43112058
4,6-dimethyl-N-(1-piperidin-3-ylethyl)pyrimidin-2-amine
CID 62044870
(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)hydrazine
CID 719979

Frequently Asked Questions

What is the IUPAC name of 5,6-dimethyl-N-(1-piperidin-3-ylethyl)thieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 5,6-dimethyl-N-(1-piperidin-3-ylethyl)thieno[2,3-d]pyrimidin-4-amine (CID 62046212) is 5,6-dimethyl-N-(1-piperidin-3-ylethyl)thieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 5,6-dimethyl-N-(1-piperidin-3-ylethyl)thieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 5,6-dimethyl-N-(1-piperidin-3-ylethyl)thieno[2,3-d]pyrimidin-4-amine is Cc1sc2ncnc(NC(C)C3CCCNC3)c2c1C.
What is the InChIKey of 5,6-dimethyl-N-(1-piperidin-3-ylethyl)thieno[2,3-d]pyrimidin-4-amine?
The InChIKey is PJPMJJDWAURSGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4S/c1-9-11(3)20-15-13(9)14(17-8-18-15)19-10(2)12-5-4-6-16-7-12/h8,10,12,16H,4-7H2,1-3H3,(H,17,18,19).
What are the key properties of 5,6-dimethyl-N-(1-piperidin-3-ylethyl)thieno[2,3-d]pyrimidin-4-amine?
5,6-dimethyl-N-(1-piperidin-3-ylethyl)thieno[2,3-d]pyrimidin-4-amine has a molecular weight of 290.44 g/mol, XLogP of 3.11, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethyl-N-(1-piperidin-3-ylethyl)thieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 62046212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).