N-cycloheptyl-7-methylthieno[3,2-d]pyrimidin-4-amine

C14H19N3S — CID 102686255

IUPACN-cycloheptyl-7-methylthieno[3,2-d]pyrimidin-4-amine
SMILESCc1csc2c(NC3CCCCCC3)ncnc12
InChIInChI=1S/C14H19N3S/c1-10-8-18-13-12(10)15-9-16-14(13)17-11-6-4-2-3-5-7-11/h8-9,11H,2-7H2,1H3,(H,15,16,17)
InChIKeyLVNIGCIIBXGZFM-UHFFFAOYSA-N
MW261.39 g/mol
LogP4.13
Rot. Bonds2

About N-cycloheptyl-7-methylthieno[3,2-d]pyrimidin-4-amine

N-cycloheptyl-7-methylthieno[3,2-d]pyrimidin-4-amine (PubChem CID 102686255) has the molecular formula C14H19N3S and a molecular weight of 261.39 g/mol. Its IUPAC name is N-cycloheptyl-7-methylthieno[3,2-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-cycloheptyl-7-methylthieno[3,2-d]pyrimidin-4-amine
PubChem CID102686255
Molecular FormulaC14H19N3S
Molecular Weight261.39 g/mol
Exact Mass261.13
IUPAC NameN-cycloheptyl-7-methylthieno[3,2-d]pyrimidin-4-amine
SMILESCc1csc2c(NC3CCCCCC3)ncnc12
InChIInChI=1S/C14H19N3S/c1-10-8-18-13-12(10)15-9-16-14(13)17-11-6-4-2-3-5-7-11/h8-9,11H,2-7H2,1H3,(H,15,16,17)
InChIKeyLVNIGCIIBXGZFM-UHFFFAOYSA-N
XLogP4.13
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.39
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-(7-methylthieno[3,2-d]pyrimidin-4-yl)cyclohexane-1,4-diamine
CID 102686178
N-cyclopent-3-en-1-yl-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686679
1-N-(7-methylthieno[3,2-d]pyrimidin-4-yl)cycloheptane-1,2-diamine
CID 102686849
7-methyl-N-(1-propylpiperidin-4-yl)thieno[3,2-d]pyrimidin-4-amine
CID 102686395
methyl 4-[(7-methylthieno[3,2-d]pyrimidin-4-yl)amino]cyclohexane-1-carboxylate
CID 102687139
N-[2-(aminomethyl)cyclohexyl]-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686896
N-(2,3-dimethylcyclohexyl)-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686234
N-(1-cyclohexylpropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686447
N-(2,2-dimethylcyclopropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686423
7-methyl-N-(2,2,3,3-tetramethylcyclopropyl)thieno[3,2-d]pyrimidin-4-amine
CID 102686575
N-(2,6-dimethylpiperidin-1-yl)-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686620
N-[[2-(aminomethyl)cyclohexyl]methyl]-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102687372

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-7-methylthieno[3,2-d]pyrimidin-4-amine?
The IUPAC name of N-cycloheptyl-7-methylthieno[3,2-d]pyrimidin-4-amine (CID 102686255) is N-cycloheptyl-7-methylthieno[3,2-d]pyrimidin-4-amine.
What is the SMILES notation for N-cycloheptyl-7-methylthieno[3,2-d]pyrimidin-4-amine?
The canonical SMILES for N-cycloheptyl-7-methylthieno[3,2-d]pyrimidin-4-amine is Cc1csc2c(NC3CCCCCC3)ncnc12.
What is the InChIKey of N-cycloheptyl-7-methylthieno[3,2-d]pyrimidin-4-amine?
The InChIKey is LVNIGCIIBXGZFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3S/c1-10-8-18-13-12(10)15-9-16-14(13)17-11-6-4-2-3-5-7-11/h8-9,11H,2-7H2,1H3,(H,15,16,17).
What are the key properties of N-cycloheptyl-7-methylthieno[3,2-d]pyrimidin-4-amine?
N-cycloheptyl-7-methylthieno[3,2-d]pyrimidin-4-amine has a molecular weight of 261.39 g/mol, XLogP of 4.13, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-7-methylthieno[3,2-d]pyrimidin-4-amine is sourced from PubChem (CID 102686255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).