2-(6-methylthieno[2,3-d]pyrimidin-4-yl)-N-propylpentan-3-amine

C15H23N3S — CID 63617907

IUPAC2-(6-methylthieno[2,3-d]pyrimidin-4-yl)-N-propylpentan-3-amine
SMILESCCCNC(CC)C(C)c1ncnc2sc(C)cc12
InChIInChI=1S/C15H23N3S/c1-5-7-16-13(6-2)11(4)14-12-8-10(3)19-15(12)18-9-17-14/h8-9,11,13,16H,5-7H2,1-4H3
InChIKeyUZOSUPIFOJDTRH-UHFFFAOYSA-N
MW277.44 g/mol
LogP3.88
Rot. Bonds6

About 2-(6-methylthieno[2,3-d]pyrimidin-4-yl)-N-propylpentan-3-amine

2-(6-methylthieno[2,3-d]pyrimidin-4-yl)-N-propylpentan-3-amine (PubChem CID 63617907) has the molecular formula C15H23N3S and a molecular weight of 277.44 g/mol. Its IUPAC name is 2-(6-methylthieno[2,3-d]pyrimidin-4-yl)-N-propylpentan-3-amine.

Molecular Properties

Compound Name2-(6-methylthieno[2,3-d]pyrimidin-4-yl)-N-propylpentan-3-amine
PubChem CID63617907
Molecular FormulaC15H23N3S
Molecular Weight277.44 g/mol
Exact Mass277.16
IUPAC Name2-(6-methylthieno[2,3-d]pyrimidin-4-yl)-N-propylpentan-3-amine
SMILESCCCNC(CC)C(C)c1ncnc2sc(C)cc12
InChIInChI=1S/C15H23N3S/c1-5-7-16-13(6-2)11(4)14-12-8-10(3)19-15(12)18-9-17-14/h8-9,11,13,16H,5-7H2,1-4H3
InChIKeyUZOSUPIFOJDTRH-UHFFFAOYSA-N
XLogP3.88
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.44
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(5-bromo-3-methyl-2-pyridinyl)-N-propylpentan-3-amine
CID 79718140
2-(6-ethylpyrimidin-4-yl)-N-propylpentan-3-amine
CID 63559776
N'-methyl-N'-(6-methylthieno[2,3-d]pyrimidin-4-yl)-N-propylethane-1,2-diamine
CID 63618416
N'-methyl-N'-(6-methylthieno[2,3-d]pyrimidin-4-yl)-N-propan-2-ylethane-1,2-diamine
CID 63617064
ethyl 2-[(6-methylthieno[2,3-d]pyrimidin-4-yl)amino]propanoate
CID 63616724
4-methyl-2-N-(6-methylthieno[2,3-d]pyrimidin-4-yl)pentane-1,2-diamine
CID 63760564
N-(1-chloro-4-methylpentan-2-yl)-6-methylthieno[2,3-d]pyrimidin-4-amine
CID 65029549
2-(2-methylquinolin-4-yl)-N-propylpentan-3-amine
CID 63562253
2-(4-tert-butylphenyl)-N-propylpentan-3-amine
CID 79307383
N,N-diethyl-6-methylthieno[2,3-d]pyrimidin-4-amine;hydrochloride
CID 2972044
2-methyl-N'-(6-methylthieno[2,3-d]pyrimidin-4-yl)propane-1,3-diamine
CID 65035565
N-[1-(2,5-dimethylthiophen-3-yl)ethyl]propan-1-amine
CID 43200455

Frequently Asked Questions

What is the IUPAC name of 2-(6-methylthieno[2,3-d]pyrimidin-4-yl)-N-propylpentan-3-amine?
The IUPAC name of 2-(6-methylthieno[2,3-d]pyrimidin-4-yl)-N-propylpentan-3-amine (CID 63617907) is 2-(6-methylthieno[2,3-d]pyrimidin-4-yl)-N-propylpentan-3-amine.
What is the SMILES notation for 2-(6-methylthieno[2,3-d]pyrimidin-4-yl)-N-propylpentan-3-amine?
The canonical SMILES for 2-(6-methylthieno[2,3-d]pyrimidin-4-yl)-N-propylpentan-3-amine is CCCNC(CC)C(C)c1ncnc2sc(C)cc12.
What is the InChIKey of 2-(6-methylthieno[2,3-d]pyrimidin-4-yl)-N-propylpentan-3-amine?
The InChIKey is UZOSUPIFOJDTRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3S/c1-5-7-16-13(6-2)11(4)14-12-8-10(3)19-15(12)18-9-17-14/h8-9,11,13,16H,5-7H2,1-4H3.
What are the key properties of 2-(6-methylthieno[2,3-d]pyrimidin-4-yl)-N-propylpentan-3-amine?
2-(6-methylthieno[2,3-d]pyrimidin-4-yl)-N-propylpentan-3-amine has a molecular weight of 277.44 g/mol, XLogP of 3.88, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methylthieno[2,3-d]pyrimidin-4-yl)-N-propylpentan-3-amine is sourced from PubChem (CID 63617907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).