4,5-dimethyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine;ethane

C15H31N3OS — CID 142273119

IUPAC4,5-dimethyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine;ethane
SMILESCC.CC.Cc1nc(NCCN2CCOCC2)sc1C
InChIInChI=1S/C11H19N3OS.2C2H6/c1-9-10(2)16-11(13-9)12-3-4-14-5-7-15-8-6-14;2*1-2/h3-8H2,1-2H3,(H,12,13);2*1-2H3
InChIKeyQFFDLXPZPGKQFP-UHFFFAOYSA-N
MW301.50 g/mol
LogP3.56
Rot. Bonds4

About 4,5-dimethyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine;ethane

4,5-dimethyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine;ethane (PubChem CID 142273119) has the molecular formula C15H31N3OS and a molecular weight of 301.50 g/mol. Its IUPAC name is 4,5-dimethyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine;ethane.

Molecular Properties

Compound Name4,5-dimethyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine;ethane
PubChem CID142273119
Molecular FormulaC15H31N3OS
Molecular Weight301.50 g/mol
Exact Mass301.22
IUPAC Name4,5-dimethyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine;ethane
SMILESCC.CC.Cc1nc(NCCN2CCOCC2)sc1C
InChIInChI=1S/C11H19N3OS.2C2H6/c1-9-10(2)16-11(13-9)12-3-4-14-5-7-15-8-6-14;2*1-2/h3-8H2,1-2H3,(H,12,13);2*1-2H3
InChIKeyQFFDLXPZPGKQFP-UHFFFAOYSA-N
XLogP3.56
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.50
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4,5-dimethyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine;ethane?
The IUPAC name of 4,5-dimethyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine;ethane (CID 142273119) is 4,5-dimethyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine;ethane.
What is the SMILES notation for 4,5-dimethyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine;ethane?
The canonical SMILES for 4,5-dimethyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine;ethane is CC.CC.Cc1nc(NCCN2CCOCC2)sc1C.
What is the InChIKey of 4,5-dimethyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine;ethane?
The InChIKey is QFFDLXPZPGKQFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3OS.2C2H6/c1-9-10(2)16-11(13-9)12-3-4-14-5-7-15-8-6-14;2*1-2/h3-8H2,1-2H3,(H,12,13);2*1-2H3.
What are the key properties of 4,5-dimethyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine;ethane?
4,5-dimethyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine;ethane has a molecular weight of 301.50 g/mol, XLogP of 3.56, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dimethyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine;ethane is sourced from PubChem (CID 142273119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).