2-[methyl-(7-methylthieno[3,2-d]pyrimidin-4-yl)amino]ethanol

C10H13N3OS — CID 2808069

IUPAC2-[methyl-(7-methylthieno[3,2-d]pyrimidin-4-yl)amino]ethanol
SMILESCc1csc2c(N(C)CCO)ncnc12
InChIInChI=1S/C10H13N3OS/c1-7-5-15-9-8(7)11-6-12-10(9)13(2)3-4-14/h5-6,14H,3-4H2,1-2H3
InChIKeyBXONNIGASLAJKS-UHFFFAOYSA-N
MW223.30 g/mol
LogP1.43
Rot. Bonds3

About 2-[methyl-(7-methylthieno[3,2-d]pyrimidin-4-yl)amino]ethanol

2-[methyl-(7-methylthieno[3,2-d]pyrimidin-4-yl)amino]ethanol (PubChem CID 2808069) has the molecular formula C10H13N3OS and a molecular weight of 223.30 g/mol. Its IUPAC name is 2-[methyl-(7-methylthieno[3,2-d]pyrimidin-4-yl)amino]ethanol.

Molecular Properties

Compound Name2-[methyl-(7-methylthieno[3,2-d]pyrimidin-4-yl)amino]ethanol
PubChem CID2808069
Molecular FormulaC10H13N3OS
Molecular Weight223.30 g/mol
Exact Mass223.08
IUPAC Name2-[methyl-(7-methylthieno[3,2-d]pyrimidin-4-yl)amino]ethanol
SMILESCc1csc2c(N(C)CCO)ncnc12
InChIInChI=1S/C10H13N3OS/c1-7-5-15-9-8(7)11-6-12-10(9)13(2)3-4-14/h5-6,14H,3-4H2,1-2H3
InChIKeyBXONNIGASLAJKS-UHFFFAOYSA-N
XLogP1.43
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.30
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[methyl-(7-methylthieno[3,2-d]pyrimidin-4-yl)amino]ethanol?
The IUPAC name of 2-[methyl-(7-methylthieno[3,2-d]pyrimidin-4-yl)amino]ethanol (CID 2808069) is 2-[methyl-(7-methylthieno[3,2-d]pyrimidin-4-yl)amino]ethanol.
What is the SMILES notation for 2-[methyl-(7-methylthieno[3,2-d]pyrimidin-4-yl)amino]ethanol?
The canonical SMILES for 2-[methyl-(7-methylthieno[3,2-d]pyrimidin-4-yl)amino]ethanol is Cc1csc2c(N(C)CCO)ncnc12.
What is the InChIKey of 2-[methyl-(7-methylthieno[3,2-d]pyrimidin-4-yl)amino]ethanol?
The InChIKey is BXONNIGASLAJKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3OS/c1-7-5-15-9-8(7)11-6-12-10(9)13(2)3-4-14/h5-6,14H,3-4H2,1-2H3.
What are the key properties of 2-[methyl-(7-methylthieno[3,2-d]pyrimidin-4-yl)amino]ethanol?
2-[methyl-(7-methylthieno[3,2-d]pyrimidin-4-yl)amino]ethanol has a molecular weight of 223.30 g/mol, XLogP of 1.43, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-(7-methylthieno[3,2-d]pyrimidin-4-yl)amino]ethanol is sourced from PubChem (CID 2808069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).