N-cyclohexyl-6-methylthieno[2,3-d]pyrimidin-4-amine;hydrochloride

C13H18ClN3S — CID 2973574

IUPACN-cyclohexyl-6-methylthieno[2,3-d]pyrimidin-4-amine;hydrochloride
SMILESCc1cc2c(NC3CCCCC3)ncnc2s1.Cl
InChIInChI=1S/C13H17N3S.ClH/c1-9-7-11-12(14-8-15-13(11)17-9)16-10-5-3-2-4-6-10;/h7-8,10H,2-6H2,1H3,(H,14,15,16);1H
InChIKeyYKPNOQDWFFDBQA-UHFFFAOYSA-N
MW283.83 g/mol
LogP4.17
Rot. Bonds2

About N-cyclohexyl-6-methylthieno[2,3-d]pyrimidin-4-amine;hydrochloride

N-cyclohexyl-6-methylthieno[2,3-d]pyrimidin-4-amine;hydrochloride (PubChem CID 2973574) has the molecular formula C13H18ClN3S and a molecular weight of 283.83 g/mol. Its IUPAC name is N-cyclohexyl-6-methylthieno[2,3-d]pyrimidin-4-amine;hydrochloride.

Molecular Properties

Compound NameN-cyclohexyl-6-methylthieno[2,3-d]pyrimidin-4-amine;hydrochloride
PubChem CID2973574
Molecular FormulaC13H18ClN3S
Molecular Weight283.83 g/mol
Exact Mass283.09
IUPAC NameN-cyclohexyl-6-methylthieno[2,3-d]pyrimidin-4-amine;hydrochloride
SMILESCc1cc2c(NC3CCCCC3)ncnc2s1.Cl
InChIInChI=1S/C13H17N3S.ClH/c1-9-7-11-12(14-8-15-13(11)17-9)16-10-5-3-2-4-6-10;/h7-8,10H,2-6H2,1H3,(H,14,15,16);1H
InChIKeyYKPNOQDWFFDBQA-UHFFFAOYSA-N
XLogP4.17
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.83
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-cyclohexyl-6-methylthieno[2,3-d]pyrimidin-4-amine;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-6-methylthieno[2,3-d]pyrimidin-4-amine;hydrochloride?
The IUPAC name of N-cyclohexyl-6-methylthieno[2,3-d]pyrimidin-4-amine;hydrochloride (CID 2973574) is N-cyclohexyl-6-methylthieno[2,3-d]pyrimidin-4-amine;hydrochloride.
What is the SMILES notation for N-cyclohexyl-6-methylthieno[2,3-d]pyrimidin-4-amine;hydrochloride?
The canonical SMILES for N-cyclohexyl-6-methylthieno[2,3-d]pyrimidin-4-amine;hydrochloride is Cc1cc2c(NC3CCCCC3)ncnc2s1.Cl.
What is the InChIKey of N-cyclohexyl-6-methylthieno[2,3-d]pyrimidin-4-amine;hydrochloride?
The InChIKey is YKPNOQDWFFDBQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3S.ClH/c1-9-7-11-12(14-8-15-13(11)17-9)16-10-5-3-2-4-6-10;/h7-8,10H,2-6H2,1H3,(H,14,15,16);1H.
What are the key properties of N-cyclohexyl-6-methylthieno[2,3-d]pyrimidin-4-amine;hydrochloride?
N-cyclohexyl-6-methylthieno[2,3-d]pyrimidin-4-amine;hydrochloride has a molecular weight of 283.83 g/mol, XLogP of 4.17, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-6-methylthieno[2,3-d]pyrimidin-4-amine;hydrochloride is sourced from PubChem (CID 2973574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).