5-N-(2-morpholin-4-ylethyl)-1,2-thiazole-3,5-diamine

C9H16N4OS — CID 103363693

IUPAC5-N-(2-morpholin-4-ylethyl)-1,2-thiazole-3,5-diamine
SMILESNc1cc(NCCN2CCOCC2)sn1
InChIInChI=1S/C9H16N4OS/c10-8-7-9(15-12-8)11-1-2-13-3-5-14-6-4-13/h7,11H,1-6H2,(H2,10,12)
InChIKeyIBPRBWGKHKACNT-UHFFFAOYSA-N
MW228.32 g/mol
LogP0.47
Rot. Bonds4

About 5-N-(2-morpholin-4-ylethyl)-1,2-thiazole-3,5-diamine

5-N-(2-morpholin-4-ylethyl)-1,2-thiazole-3,5-diamine (PubChem CID 103363693) has the molecular formula C9H16N4OS and a molecular weight of 228.32 g/mol. Its IUPAC name is 5-N-(2-morpholin-4-ylethyl)-1,2-thiazole-3,5-diamine.

Molecular Properties

Compound Name5-N-(2-morpholin-4-ylethyl)-1,2-thiazole-3,5-diamine
PubChem CID103363693
Molecular FormulaC9H16N4OS
Molecular Weight228.32 g/mol
Exact Mass228.10
IUPAC Name5-N-(2-morpholin-4-ylethyl)-1,2-thiazole-3,5-diamine
SMILESNc1cc(NCCN2CCOCC2)sn1
InChIInChI=1S/C9H16N4OS/c10-8-7-9(15-12-8)11-1-2-13-3-5-14-6-4-13/h7,11H,1-6H2,(H2,10,12)
InChIKeyIBPRBWGKHKACNT-UHFFFAOYSA-N
XLogP0.47
TPSA63.41 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.32
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-N-(3,3-dimethylbutyl)-1,2-thiazole-3,5-diamine
CID 103365523
6-methyl-4-N-(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 67328297
3,5-dichloro-6-N-(2-morpholin-4-ylethyl)pyridine-2,6-diamine
CID 102755704
5-N-(2-cyclopentylethyl)-1,2-thiazole-3,5-diamine
CID 103364211
2-chloro-1-N-(2-morpholin-4-ylethyl)benzene-1,4-diamine
CID 28904413
5-iodo-1-N,3-N-bis(2-morpholin-4-ylethyl)benzene-1,3-diamine
CID 153298189
4-chloro-N-(2-morpholin-4-ylethyl)aniline
CID 28580807
2-N-(2-morpholin-4-ylethyl)pyridine-2,3-diamine
CID 14417721
methyl 3-amino-5-(2-morpholin-4-ylethylamino)-1,2-thiazole-4-carboxylate
CID 103382611
3-N-(2-morpholin-4-ylethyl)-6-phenylpyridazine-3,4-diamine;hydrochloride
CID 45262908
4-N-cyclopropyl-6-N-(2-morpholin-4-ylethyl)pyrimidine-2,4,6-triamine
CID 117093770
2,4,5-trimethyl-N-(2-morpholin-4-ylethyl)aniline
CID 82498851

Frequently Asked Questions

What is the IUPAC name of 5-N-(2-morpholin-4-ylethyl)-1,2-thiazole-3,5-diamine?
The IUPAC name of 5-N-(2-morpholin-4-ylethyl)-1,2-thiazole-3,5-diamine (CID 103363693) is 5-N-(2-morpholin-4-ylethyl)-1,2-thiazole-3,5-diamine.
What is the SMILES notation for 5-N-(2-morpholin-4-ylethyl)-1,2-thiazole-3,5-diamine?
The canonical SMILES for 5-N-(2-morpholin-4-ylethyl)-1,2-thiazole-3,5-diamine is Nc1cc(NCCN2CCOCC2)sn1.
What is the InChIKey of 5-N-(2-morpholin-4-ylethyl)-1,2-thiazole-3,5-diamine?
The InChIKey is IBPRBWGKHKACNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4OS/c10-8-7-9(15-12-8)11-1-2-13-3-5-14-6-4-13/h7,11H,1-6H2,(H2,10,12).
What are the key properties of 5-N-(2-morpholin-4-ylethyl)-1,2-thiazole-3,5-diamine?
5-N-(2-morpholin-4-ylethyl)-1,2-thiazole-3,5-diamine has a molecular weight of 228.32 g/mol, XLogP of 0.47, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(2-morpholin-4-ylethyl)-1,2-thiazole-3,5-diamine is sourced from PubChem (CID 103363693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).