4-amino-2-morpholin-4-yl-1,3-thiazole-5-carbonitrile

C8H10N4OS — CID 21319839

IUPAC4-amino-2-morpholin-4-yl-1,3-thiazole-5-carbonitrile
SMILESN#Cc1sc(N2CCOCC2)nc1N
InChIInChI=1S/C8H10N4OS/c9-5-6-7(10)11-8(14-6)12-1-3-13-4-2-12/h1-4,10H2
InChIKeyUIYOZICJTFXJEZ-UHFFFAOYSA-N
MW210.26 g/mol
LogP0.43
Rot. Bonds1

About 4-amino-2-morpholin-4-yl-1,3-thiazole-5-carbonitrile

4-amino-2-morpholin-4-yl-1,3-thiazole-5-carbonitrile (PubChem CID 21319839) has the molecular formula C8H10N4OS and a molecular weight of 210.26 g/mol. Its IUPAC name is 4-amino-2-morpholin-4-yl-1,3-thiazole-5-carbonitrile.

Molecular Properties

Compound Name4-amino-2-morpholin-4-yl-1,3-thiazole-5-carbonitrile
PubChem CID21319839
Molecular FormulaC8H10N4OS
Molecular Weight210.26 g/mol
Exact Mass210.06
IUPAC Name4-amino-2-morpholin-4-yl-1,3-thiazole-5-carbonitrile
SMILESN#Cc1sc(N2CCOCC2)nc1N
InChIInChI=1S/C8H10N4OS/c9-5-6-7(10)11-8(14-6)12-1-3-13-4-2-12/h1-4,10H2
InChIKeyUIYOZICJTFXJEZ-UHFFFAOYSA-N
XLogP0.43
TPSA75.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.26
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-morpholin-4-yl-4-propyl-1,3-thiazole-5-carbonitrile
CID 82433394
4-amino-2-morpholin-4-yl-1,3-thiazole-5-carboxylic acid
CID 154487330
2,6-dimorpholin-4-yl-1,3,5-thiadiazin-4-one
CID 15063236
4-amino-N-(1-methylcyclopropyl)-2-morpholin-4-yl-1,3-thiazole-5-carboxamide
CID 116672709
3-amino-6-morpholin-4-ylthieno[2,3-b]pyridine-2,5-dicarbonitrile
CID 135077711
3-amino-4-methylsulfanyl-5-morpholin-4-ylthiophene-2-carbonitrile
CID 103419029
4-amino-2-morpholin-4-yl-N-prop-2-ynyl-1,3-thiazole-5-carboxamide
CID 116667349
1-amino-5-morpholin-4-yl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carbonitrile
CID 687349
4-amino-N-(1-methylcyclopentyl)-2-morpholin-4-yl-1,3-thiazole-5-carboxamide
CID 116670895
4-amino-N-(2-amino-2-oxoethyl)-2-morpholin-4-yl-1,3-thiazole-5-carboxamide
CID 116667829
4-amino-N-methyl-2-morpholin-4-yl-N-prop-2-ynyl-1,3-thiazole-5-carboxamide
CID 116671879
4-(5-methyl-2-morpholin-4-yl-1,3-thiazol-4-yl)morpholine
CID 59034806

Frequently Asked Questions

What is the IUPAC name of 4-amino-2-morpholin-4-yl-1,3-thiazole-5-carbonitrile?
The IUPAC name of 4-amino-2-morpholin-4-yl-1,3-thiazole-5-carbonitrile (CID 21319839) is 4-amino-2-morpholin-4-yl-1,3-thiazole-5-carbonitrile.
What is the SMILES notation for 4-amino-2-morpholin-4-yl-1,3-thiazole-5-carbonitrile?
The canonical SMILES for 4-amino-2-morpholin-4-yl-1,3-thiazole-5-carbonitrile is N#Cc1sc(N2CCOCC2)nc1N.
What is the InChIKey of 4-amino-2-morpholin-4-yl-1,3-thiazole-5-carbonitrile?
The InChIKey is UIYOZICJTFXJEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4OS/c9-5-6-7(10)11-8(14-6)12-1-3-13-4-2-12/h1-4,10H2.
What are the key properties of 4-amino-2-morpholin-4-yl-1,3-thiazole-5-carbonitrile?
4-amino-2-morpholin-4-yl-1,3-thiazole-5-carbonitrile has a molecular weight of 210.26 g/mol, XLogP of 0.43, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-morpholin-4-yl-1,3-thiazole-5-carbonitrile is sourced from PubChem (CID 21319839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).