7-methyl-N-[(2-methylcyclohexyl)methyl]thieno[3,2-d]pyrimidin-4-amine

C15H21N3S — CID 102686404

IUPAC7-methyl-N-[(2-methylcyclohexyl)methyl]thieno[3,2-d]pyrimidin-4-amine
SMILESCc1csc2c(NCC3CCCCC3C)ncnc12
InChIInChI=1S/C15H21N3S/c1-10-5-3-4-6-12(10)7-16-15-14-13(17-9-18-15)11(2)8-19-14/h8-10,12H,3-7H2,1-2H3,(H,16,17,18)
InChIKeyLTKGCVOOOSXVHS-UHFFFAOYSA-N
MW275.42 g/mol
LogP4.24
Rot. Bonds3

About 7-methyl-N-[(2-methylcyclohexyl)methyl]thieno[3,2-d]pyrimidin-4-amine

7-methyl-N-[(2-methylcyclohexyl)methyl]thieno[3,2-d]pyrimidin-4-amine (PubChem CID 102686404) has the molecular formula C15H21N3S and a molecular weight of 275.42 g/mol. Its IUPAC name is 7-methyl-N-[(2-methylcyclohexyl)methyl]thieno[3,2-d]pyrimidin-4-amine.

Molecular Properties

Compound Name7-methyl-N-[(2-methylcyclohexyl)methyl]thieno[3,2-d]pyrimidin-4-amine
PubChem CID102686404
Molecular FormulaC15H21N3S
Molecular Weight275.42 g/mol
Exact Mass275.15
IUPAC Name7-methyl-N-[(2-methylcyclohexyl)methyl]thieno[3,2-d]pyrimidin-4-amine
SMILESCc1csc2c(NCC3CCCCC3C)ncnc12
InChIInChI=1S/C15H21N3S/c1-10-5-3-4-6-12(10)7-16-15-14-13(17-9-18-15)11(2)8-19-14/h8-10,12H,3-7H2,1-2H3,(H,16,17,18)
InChIKeyLTKGCVOOOSXVHS-UHFFFAOYSA-N
XLogP4.24
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.42
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[2-(aminomethyl)cyclohexyl]methyl]-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102687372
N-[2-(aminomethyl)cyclohexyl]-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686896
N-[(3-chlorocyclopentyl)methyl]-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 114146588
N-(2,3-dimethylcyclohexyl)-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686234
N-cycloheptyl-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686255
5-methyl-4-N-[(2-methylcyclohexyl)methyl]pyrimidine-4,6-diamine
CID 80815368
1-N-(7-methylthieno[3,2-d]pyrimidin-4-yl)cycloheptane-1,2-diamine
CID 102686849
N-(2-cyclopropylpropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686678
N-[(1,4-dimethylpiperazin-2-yl)methyl]-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686498
N-(2,6-dimethylpiperidin-1-yl)-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686620
6-hydrazinyl-5-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine
CID 107421319
N-(1-cyclohexylpropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686447

Frequently Asked Questions

What is the IUPAC name of 7-methyl-N-[(2-methylcyclohexyl)methyl]thieno[3,2-d]pyrimidin-4-amine?
The IUPAC name of 7-methyl-N-[(2-methylcyclohexyl)methyl]thieno[3,2-d]pyrimidin-4-amine (CID 102686404) is 7-methyl-N-[(2-methylcyclohexyl)methyl]thieno[3,2-d]pyrimidin-4-amine.
What is the SMILES notation for 7-methyl-N-[(2-methylcyclohexyl)methyl]thieno[3,2-d]pyrimidin-4-amine?
The canonical SMILES for 7-methyl-N-[(2-methylcyclohexyl)methyl]thieno[3,2-d]pyrimidin-4-amine is Cc1csc2c(NCC3CCCCC3C)ncnc12.
What is the InChIKey of 7-methyl-N-[(2-methylcyclohexyl)methyl]thieno[3,2-d]pyrimidin-4-amine?
The InChIKey is LTKGCVOOOSXVHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3S/c1-10-5-3-4-6-12(10)7-16-15-14-13(17-9-18-15)11(2)8-19-14/h8-10,12H,3-7H2,1-2H3,(H,16,17,18).
What are the key properties of 7-methyl-N-[(2-methylcyclohexyl)methyl]thieno[3,2-d]pyrimidin-4-amine?
7-methyl-N-[(2-methylcyclohexyl)methyl]thieno[3,2-d]pyrimidin-4-amine has a molecular weight of 275.42 g/mol, XLogP of 4.24, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-N-[(2-methylcyclohexyl)methyl]thieno[3,2-d]pyrimidin-4-amine is sourced from PubChem (CID 102686404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).