1-N-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,2-diamine

C10H14N4S — CID 102686862

IUPAC1-N-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,2-diamine
SMILESCc1csc2c(NCC(C)N)ncnc12
InChIInChI=1S/C10H14N4S/c1-6-4-15-9-8(6)13-5-14-10(9)12-3-7(2)11/h4-5,7H,3,11H2,1-2H3,(H,12,13,14)
InChIKeyKJOAKRPPOCWMNP-UHFFFAOYSA-N
MW222.32 g/mol
LogP1.76
Rot. Bonds3

About 1-N-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,2-diamine

1-N-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,2-diamine (PubChem CID 102686862) has the molecular formula C10H14N4S and a molecular weight of 222.32 g/mol. Its IUPAC name is 1-N-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,2-diamine.

Molecular Properties

Compound Name1-N-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,2-diamine
PubChem CID102686862
Molecular FormulaC10H14N4S
Molecular Weight222.32 g/mol
Exact Mass222.09
IUPAC Name1-N-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,2-diamine
SMILESCc1csc2c(NCC(C)N)ncnc12
InChIInChI=1S/C10H14N4S/c1-6-4-15-9-8(6)13-5-14-10(9)12-3-7(2)11/h4-5,7H,3,11H2,1-2H3,(H,12,13,14)
InChIKeyKJOAKRPPOCWMNP-UHFFFAOYSA-N
XLogP1.76
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.32
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-N'-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,3-diamine
CID 102687370
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)butane-1,4-diamine
CID 102687379
N-(2-cyclopropylpropyl)-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686678
3-[(7-methylthieno[3,2-d]pyrimidin-4-yl)amino]propane-1,2-diol
CID 102686564
7-methyl-N-(2-propan-2-yloxyethyl)thieno[3,2-d]pyrimidin-4-amine
CID 102686662
4-methyl-2-[[(7-methylthieno[3,2-d]pyrimidin-4-yl)amino]methyl]pentanoic acid
CID 102686030
N'-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,3-diamine
CID 102686176
7-methyl-N-pentan-2-ylthieno[3,2-d]pyrimidin-4-amine
CID 102686212
2,2-dimethyl-N-(7-methylthieno[3,2-d]pyrimidin-4-yl)butane-1,4-diamine
CID 106142308
N-[[2-(aminomethyl)cyclohexyl]methyl]-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102687372
7-methyl-N-[(4-methylphenyl)methyl]thieno[3,2-d]pyrimidin-4-amine
CID 102686243

Frequently Asked Questions

What is the IUPAC name of 1-N-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,2-diamine?
The IUPAC name of 1-N-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,2-diamine (CID 102686862) is 1-N-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,2-diamine.
What is the SMILES notation for 1-N-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,2-diamine?
The canonical SMILES for 1-N-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,2-diamine is Cc1csc2c(NCC(C)N)ncnc12.
What is the InChIKey of 1-N-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,2-diamine?
The InChIKey is KJOAKRPPOCWMNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4S/c1-6-4-15-9-8(6)13-5-14-10(9)12-3-7(2)11/h4-5,7H,3,11H2,1-2H3,(H,12,13,14).
What are the key properties of 1-N-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,2-diamine?
1-N-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,2-diamine has a molecular weight of 222.32 g/mol, XLogP of 1.76, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(7-methylthieno[3,2-d]pyrimidin-4-yl)propane-1,2-diamine is sourced from PubChem (CID 102686862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).