2-(morpholin-4-ylmethyl)-1,3-thiazol-5-amine

C8H13N3OS — CID 22397141

IUPAC2-(morpholin-4-ylmethyl)-1,3-thiazol-5-amine
SMILESNc1cnc(CN2CCOCC2)s1
InChIInChI=1S/C8H13N3OS/c9-7-5-10-8(13-7)6-11-1-3-12-4-2-11/h5H,1-4,6,9H2
InChIKeyWXRTUDXQAJRAJL-UHFFFAOYSA-N
MW199.28 g/mol
LogP0.56
Rot. Bonds2

About 2-(morpholin-4-ylmethyl)-1,3-thiazol-5-amine

2-(morpholin-4-ylmethyl)-1,3-thiazol-5-amine (PubChem CID 22397141) has the molecular formula C8H13N3OS and a molecular weight of 199.28 g/mol. Its IUPAC name is 2-(morpholin-4-ylmethyl)-1,3-thiazol-5-amine.

Molecular Properties

Compound Name2-(morpholin-4-ylmethyl)-1,3-thiazol-5-amine
PubChem CID22397141
Molecular FormulaC8H13N3OS
Molecular Weight199.28 g/mol
Exact Mass199.08
IUPAC Name2-(morpholin-4-ylmethyl)-1,3-thiazol-5-amine
SMILESNc1cnc(CN2CCOCC2)s1
InChIInChI=1S/C8H13N3OS/c9-7-5-10-8(13-7)6-11-1-3-12-4-2-11/h5H,1-4,6,9H2
InChIKeyWXRTUDXQAJRAJL-UHFFFAOYSA-N
XLogP0.56
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.28
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-Bromo-5-morpholinothiazole
CID 60076349
2-(4-Morpholinylcarbonyl)-1,3-thiazol-5-amine
CID 22397226
Morpholine;1,3-thiazole
CID 23459351
4-(1,3-Thiazol-2-ylmethyl)morpholine
CID 57194818
4-(2-Tert-butyl-1,3-thiazol-5-yl)morpholine
CID 59019195
2-(5-Morpholin-4-yl-1,3-thiazol-2-yl)propan-2-amine
CID 59019627
5-Morpholin-4-yl-thiazol-2-ylamine
CID 59301285
2-Morpholin-4-yl-thiazol-5-ylamine
CID 66520644
2-(Methoxymethyl)-1,3-thiazol-5-amine
CID 68295861
(2-Morpholin-4-ylmethyl-thiazol-5-yl)-carbamic acid tert-butyl ester
CID 68516619
2-Morpholin-4-yl-2-(1,3-thiazol-2-yl)ethanamine
CID 83534009
5-(4-Morpholinyl)-2-thiazolecarbonitrile
CID 85848338

Frequently Asked Questions

What is the IUPAC name of 2-(morpholin-4-ylmethyl)-1,3-thiazol-5-amine?
The IUPAC name of 2-(morpholin-4-ylmethyl)-1,3-thiazol-5-amine (CID 22397141) is 2-(morpholin-4-ylmethyl)-1,3-thiazol-5-amine.
What is the SMILES notation for 2-(morpholin-4-ylmethyl)-1,3-thiazol-5-amine?
The canonical SMILES for 2-(morpholin-4-ylmethyl)-1,3-thiazol-5-amine is Nc1cnc(CN2CCOCC2)s1.
What is the InChIKey of 2-(morpholin-4-ylmethyl)-1,3-thiazol-5-amine?
The InChIKey is WXRTUDXQAJRAJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3OS/c9-7-5-10-8(13-7)6-11-1-3-12-4-2-11/h5H,1-4,6,9H2.
What are the key properties of 2-(morpholin-4-ylmethyl)-1,3-thiazol-5-amine?
2-(morpholin-4-ylmethyl)-1,3-thiazol-5-amine has a molecular weight of 199.28 g/mol, XLogP of 0.56, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(morpholin-4-ylmethyl)-1,3-thiazol-5-amine is sourced from PubChem (CID 22397141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).