N,N-diethyl-2-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine

C15H22N4OS — CID 155567356

IUPACN,N-diethyl-2-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine
SMILESCCN(CC)c1nc(CN2CCOCC2)nc2sccc12
InChIInChI=1S/C15H22N4OS/c1-3-19(4-2)14-12-5-10-21-15(12)17-13(16-14)11-18-6-8-20-9-7-18/h5,10H,3-4,6-9,11H2,1-2H3
InChIKeyQITRYPAGCGCLNH-UHFFFAOYSA-N
MW306.43 g/mol
LogP2.37
Rot. Bonds5

About N,N-diethyl-2-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine

N,N-diethyl-2-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine (PubChem CID 155567356) has the molecular formula C15H22N4OS and a molecular weight of 306.43 g/mol. Its IUPAC name is N,N-diethyl-2-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN,N-diethyl-2-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine
PubChem CID155567356
Molecular FormulaC15H22N4OS
Molecular Weight306.43 g/mol
Exact Mass306.15
IUPAC NameN,N-diethyl-2-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine
SMILESCCN(CC)c1nc(CN2CCOCC2)nc2sccc12
InChIInChI=1S/C15H22N4OS/c1-3-19(4-2)14-12-5-10-21-15(12)17-13(16-14)11-18-6-8-20-9-7-18/h5,10H,3-4,6-9,11H2,1-2H3
InChIKeyQITRYPAGCGCLNH-UHFFFAOYSA-N
XLogP2.37
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.43
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of N,N-diethyl-2-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine (CID 155567356) is N,N-diethyl-2-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N,N-diethyl-2-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N,N-diethyl-2-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine is CCN(CC)c1nc(CN2CCOCC2)nc2sccc12.
What is the InChIKey of N,N-diethyl-2-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine?
The InChIKey is QITRYPAGCGCLNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4OS/c1-3-19(4-2)14-12-5-10-21-15(12)17-13(16-14)11-18-6-8-20-9-7-18/h5,10H,3-4,6-9,11H2,1-2H3.
What are the key properties of N,N-diethyl-2-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine?
N,N-diethyl-2-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine has a molecular weight of 306.43 g/mol, XLogP of 2.37, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 155567356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).