N-cyclohexyl-N,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine

C15H21N3S — CID 3426162

IUPACN-cyclohexyl-N,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine
SMILESCc1sc2ncnc(N(C)C3CCCCC3)c2c1C
InChIInChI=1S/C15H21N3S/c1-10-11(2)19-15-13(10)14(16-9-17-15)18(3)12-7-5-4-6-8-12/h9,12H,4-8H2,1-3H3
InChIKeyVQVOGAHOYLKHBL-UHFFFAOYSA-N
MW275.42 g/mol
LogP4.08
Rot. Bonds2

About N-cyclohexyl-N,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine

N-cyclohexyl-N,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 3426162) has the molecular formula C15H21N3S and a molecular weight of 275.42 g/mol. Its IUPAC name is N-cyclohexyl-N,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-cyclohexyl-N,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine
PubChem CID3426162
Molecular FormulaC15H21N3S
Molecular Weight275.42 g/mol
Exact Mass275.15
IUPAC NameN-cyclohexyl-N,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine
SMILESCc1sc2ncnc(N(C)C3CCCCC3)c2c1C
InChIInChI=1S/C15H21N3S/c1-10-11(2)19-15-13(10)14(16-9-17-15)18(3)12-7-5-4-6-8-12/h9,12H,4-8H2,1-3H3
InChIKeyVQVOGAHOYLKHBL-UHFFFAOYSA-N
XLogP4.08
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.42
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of N-cyclohexyl-N,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine (CID 3426162) is N-cyclohexyl-N,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N-cyclohexyl-N,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N-cyclohexyl-N,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine is Cc1sc2ncnc(N(C)C3CCCCC3)c2c1C.
What is the InChIKey of N-cyclohexyl-N,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is VQVOGAHOYLKHBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3S/c1-10-11(2)19-15-13(10)14(16-9-17-15)18(3)12-7-5-4-6-8-12/h9,12H,4-8H2,1-3H3.
What are the key properties of N-cyclohexyl-N,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine?
N-cyclohexyl-N,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 275.42 g/mol, XLogP of 4.08, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 3426162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).