7-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[3,2-d]pyrimidin-4-amine

C13H15N5S — CID 102686598

IUPAC7-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[3,2-d]pyrimidin-4-amine
SMILESCc1csc2c(NCCc3cnn(C)c3)ncnc12
InChIInChI=1S/C13H15N5S/c1-9-7-19-12-11(9)15-8-16-13(12)14-4-3-10-5-17-18(2)6-10/h5-8H,3-4H2,1-2H3,(H,14,15,16)
InChIKeyUQKHQWSYTIIVPI-UHFFFAOYSA-N
MW273.37 g/mol
LogP2.39
Rot. Bonds4

About 7-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[3,2-d]pyrimidin-4-amine

7-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[3,2-d]pyrimidin-4-amine (PubChem CID 102686598) has the molecular formula C13H15N5S and a molecular weight of 273.37 g/mol. Its IUPAC name is 7-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[3,2-d]pyrimidin-4-amine.

Molecular Properties

Compound Name7-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[3,2-d]pyrimidin-4-amine
PubChem CID102686598
Molecular FormulaC13H15N5S
Molecular Weight273.37 g/mol
Exact Mass273.10
IUPAC Name7-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[3,2-d]pyrimidin-4-amine
SMILESCc1csc2c(NCCc3cnn(C)c3)ncnc12
InChIInChI=1S/C13H15N5S/c1-9-7-19-12-11(9)15-8-16-13(12)14-4-3-10-5-17-18(2)6-10/h5-8H,3-4H2,1-2H3,(H,14,15,16)
InChIKeyUQKHQWSYTIIVPI-UHFFFAOYSA-N
XLogP2.39
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.37
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N'-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,3-diamine
CID 102686176
7-methyl-N-(2-propan-2-yloxyethyl)thieno[3,2-d]pyrimidin-4-amine
CID 102686662
7-methyl-N-[(4-methylphenyl)methyl]thieno[3,2-d]pyrimidin-4-amine
CID 102686243
1-N-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,2-diamine
CID 102686862
5-methyl-2-N-[2-(1-methylpyrazol-4-yl)ethyl]pyridine-2,3-diamine
CID 80681081
6-N-ethyl-4-N-[2-(1-methylpyrazol-4-yl)ethyl]pyrimidine-4,6-diamine
CID 80853555
3-bromo-5-chloro-N-[2-(1-methylpyrazol-4-yl)ethyl]pyridin-2-amine
CID 114836017
3,5-dichloro-N-[2-(1-methylpyrazol-4-yl)ethyl]pyridin-2-amine
CID 80688948
N-[2-(1-methylpyrazol-4-yl)ethyl]-6-propylpyrimidin-4-amine
CID 80689109
2-[[(7-methylthieno[3,2-d]pyrimidin-4-yl)amino]methyl]phenol
CID 102686720
6-methyl-2-N-[2-(1-methylpyrazol-4-yl)ethyl]pyridine-2,3-diamine
CID 81131882
7-methyl-N-[(4-methylpiperidin-4-yl)methyl]thieno[3,2-d]pyrimidin-4-amine
CID 102686960

Frequently Asked Questions

What is the IUPAC name of 7-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[3,2-d]pyrimidin-4-amine?
The IUPAC name of 7-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[3,2-d]pyrimidin-4-amine (CID 102686598) is 7-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[3,2-d]pyrimidin-4-amine.
What is the SMILES notation for 7-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[3,2-d]pyrimidin-4-amine?
The canonical SMILES for 7-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[3,2-d]pyrimidin-4-amine is Cc1csc2c(NCCc3cnn(C)c3)ncnc12.
What is the InChIKey of 7-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[3,2-d]pyrimidin-4-amine?
The InChIKey is UQKHQWSYTIIVPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N5S/c1-9-7-19-12-11(9)15-8-16-13(12)14-4-3-10-5-17-18(2)6-10/h5-8H,3-4H2,1-2H3,(H,14,15,16).
What are the key properties of 7-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[3,2-d]pyrimidin-4-amine?
7-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[3,2-d]pyrimidin-4-amine has a molecular weight of 273.37 g/mol, XLogP of 2.39, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[3,2-d]pyrimidin-4-amine is sourced from PubChem (CID 102686598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).