N-(2-cyclopropylpropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine

C13H17N3S — CID 102686678

IUPACN-(2-cyclopropylpropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine
SMILESCc1csc2c(NCC(C)C3CC3)ncnc12
InChIInChI=1S/C13H17N3S/c1-8(10-3-4-10)5-14-13-12-11(15-7-16-13)9(2)6-17-12/h6-8,10H,3-5H2,1-2H3,(H,14,15,16)
InChIKeyMVMRTDPITHPIFM-UHFFFAOYSA-N
MW247.37 g/mol
LogP3.46
Rot. Bonds4

About N-(2-cyclopropylpropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine

N-(2-cyclopropylpropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine (PubChem CID 102686678) has the molecular formula C13H17N3S and a molecular weight of 247.37 g/mol. Its IUPAC name is N-(2-cyclopropylpropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-(2-cyclopropylpropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine
PubChem CID102686678
Molecular FormulaC13H17N3S
Molecular Weight247.37 g/mol
Exact Mass247.11
IUPAC NameN-(2-cyclopropylpropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine
SMILESCc1csc2c(NCC(C)C3CC3)ncnc12
InChIInChI=1S/C13H17N3S/c1-8(10-3-4-10)5-14-13-12-11(15-7-16-13)9(2)6-17-12/h6-8,10H,3-5H2,1-2H3,(H,14,15,16)
InChIKeyMVMRTDPITHPIFM-UHFFFAOYSA-N
XLogP3.46
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.37
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-N-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,2-diamine
CID 102686862
N,2-dimethyl-N'-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,3-diamine
CID 102686940
2-methyl-N'-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,3-diamine
CID 102687370
2-methyl-N-(7-methylthieno[3,2-d]pyrimidin-4-yl)butane-1,4-diamine
CID 102687379
7-methyl-N-(2-propan-2-yloxyethyl)thieno[3,2-d]pyrimidin-4-amine
CID 102686662
3-[(7-methylthieno[3,2-d]pyrimidin-4-yl)amino]propane-1,2-diol
CID 102686564
4-methyl-2-[[(7-methylthieno[3,2-d]pyrimidin-4-yl)amino]methyl]pentanoic acid
CID 102686030
7-methyl-N-[(2-methylcyclohexyl)methyl]thieno[3,2-d]pyrimidin-4-amine
CID 102686404
N-[(3-chlorocyclopentyl)methyl]-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 114146588
N-[[2-(aminomethyl)cyclohexyl]methyl]-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102687372
N-(1-cyclohexylpropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686447
N-cycloheptyl-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686255

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropylpropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine?
The IUPAC name of N-(2-cyclopropylpropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine (CID 102686678) is N-(2-cyclopropylpropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine.
What is the SMILES notation for N-(2-cyclopropylpropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine?
The canonical SMILES for N-(2-cyclopropylpropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine is Cc1csc2c(NCC(C)C3CC3)ncnc12.
What is the InChIKey of N-(2-cyclopropylpropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine?
The InChIKey is MVMRTDPITHPIFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3S/c1-8(10-3-4-10)5-14-13-12-11(15-7-16-13)9(2)6-17-12/h6-8,10H,3-5H2,1-2H3,(H,14,15,16).
What are the key properties of N-(2-cyclopropylpropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine?
N-(2-cyclopropylpropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine has a molecular weight of 247.37 g/mol, XLogP of 3.46, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropylpropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine is sourced from PubChem (CID 102686678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).