N-ethyl-4-(2-methylmorpholin-4-yl)thieno[2,3-d]pyrimidin-2-amine

C13H18N4OS — CID 103323885

IUPACN-ethyl-4-(2-methylmorpholin-4-yl)thieno[2,3-d]pyrimidin-2-amine
SMILESCCNc1nc(N2CCOC(C)C2)c2ccsc2n1
InChIInChI=1S/C13H18N4OS/c1-3-14-13-15-11(10-4-7-19-12(10)16-13)17-5-6-18-9(2)8-17/h4,7,9H,3,5-6,8H2,1-2H3,(H,14,15,16)
InChIKeyKFTYHPGOHWRWMW-UHFFFAOYSA-N
MW278.38 g/mol
LogP2.35
Rot. Bonds3

About N-ethyl-4-(2-methylmorpholin-4-yl)thieno[2,3-d]pyrimidin-2-amine

N-ethyl-4-(2-methylmorpholin-4-yl)thieno[2,3-d]pyrimidin-2-amine (PubChem CID 103323885) has the molecular formula C13H18N4OS and a molecular weight of 278.38 g/mol. Its IUPAC name is N-ethyl-4-(2-methylmorpholin-4-yl)thieno[2,3-d]pyrimidin-2-amine.

Molecular Properties

Compound NameN-ethyl-4-(2-methylmorpholin-4-yl)thieno[2,3-d]pyrimidin-2-amine
PubChem CID103323885
Molecular FormulaC13H18N4OS
Molecular Weight278.38 g/mol
Exact Mass278.12
IUPAC NameN-ethyl-4-(2-methylmorpholin-4-yl)thieno[2,3-d]pyrimidin-2-amine
SMILESCCNc1nc(N2CCOC(C)C2)c2ccsc2n1
InChIInChI=1S/C13H18N4OS/c1-3-14-13-15-11(10-4-7-19-12(10)16-13)17-5-6-18-9(2)8-17/h4,7,9H,3,5-6,8H2,1-2H3,(H,14,15,16)
InChIKeyKFTYHPGOHWRWMW-UHFFFAOYSA-N
XLogP2.35
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.38
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-(2-methylmorpholin-4-yl)thieno[2,3-d]pyrimidin-2-amine?
The IUPAC name of N-ethyl-4-(2-methylmorpholin-4-yl)thieno[2,3-d]pyrimidin-2-amine (CID 103323885) is N-ethyl-4-(2-methylmorpholin-4-yl)thieno[2,3-d]pyrimidin-2-amine.
What is the SMILES notation for N-ethyl-4-(2-methylmorpholin-4-yl)thieno[2,3-d]pyrimidin-2-amine?
The canonical SMILES for N-ethyl-4-(2-methylmorpholin-4-yl)thieno[2,3-d]pyrimidin-2-amine is CCNc1nc(N2CCOC(C)C2)c2ccsc2n1.
What is the InChIKey of N-ethyl-4-(2-methylmorpholin-4-yl)thieno[2,3-d]pyrimidin-2-amine?
The InChIKey is KFTYHPGOHWRWMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4OS/c1-3-14-13-15-11(10-4-7-19-12(10)16-13)17-5-6-18-9(2)8-17/h4,7,9H,3,5-6,8H2,1-2H3,(H,14,15,16).
What are the key properties of N-ethyl-4-(2-methylmorpholin-4-yl)thieno[2,3-d]pyrimidin-2-amine?
N-ethyl-4-(2-methylmorpholin-4-yl)thieno[2,3-d]pyrimidin-2-amine has a molecular weight of 278.38 g/mol, XLogP of 2.35, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-(2-methylmorpholin-4-yl)thieno[2,3-d]pyrimidin-2-amine is sourced from PubChem (CID 103323885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).