N-(5-morpholin-4-yl-1,3-thiazol-2-yl)formamide

C8H11N3O2S — CID 15398953

IUPACN-(5-morpholin-4-yl-1,3-thiazol-2-yl)formamide
SMILESO=CNc1ncc(N2CCOCC2)s1
InChIInChI=1S/C8H11N3O2S/c12-6-10-8-9-5-7(14-8)11-1-3-13-4-2-11/h5-6H,1-4H2,(H,9,10,12)
InChIKeyPASCIVCCTVXYPJ-UHFFFAOYSA-N
MW213.26 g/mol
LogP0.55
Rot. Bonds3

About N-(5-morpholin-4-yl-1,3-thiazol-2-yl)formamide

N-(5-morpholin-4-yl-1,3-thiazol-2-yl)formamide (PubChem CID 15398953) has the molecular formula C8H11N3O2S and a molecular weight of 213.26 g/mol. Its IUPAC name is N-(5-morpholin-4-yl-1,3-thiazol-2-yl)formamide.

Molecular Properties

Compound NameN-(5-morpholin-4-yl-1,3-thiazol-2-yl)formamide
PubChem CID15398953
Molecular FormulaC8H11N3O2S
Molecular Weight213.26 g/mol
Exact Mass213.06
IUPAC NameN-(5-morpholin-4-yl-1,3-thiazol-2-yl)formamide
SMILESO=CNc1ncc(N2CCOCC2)s1
InChIInChI=1S/C8H11N3O2S/c12-6-10-8-9-5-7(14-8)11-1-3-13-4-2-11/h5-6H,1-4H2,(H,9,10,12)
InChIKeyPASCIVCCTVXYPJ-UHFFFAOYSA-N
XLogP0.55
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.26
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(5-morpholin-4-yl-1,3-thiazol-2-yl)formamide?
The IUPAC name of N-(5-morpholin-4-yl-1,3-thiazol-2-yl)formamide (CID 15398953) is N-(5-morpholin-4-yl-1,3-thiazol-2-yl)formamide.
What is the SMILES notation for N-(5-morpholin-4-yl-1,3-thiazol-2-yl)formamide?
The canonical SMILES for N-(5-morpholin-4-yl-1,3-thiazol-2-yl)formamide is O=CNc1ncc(N2CCOCC2)s1.
What is the InChIKey of N-(5-morpholin-4-yl-1,3-thiazol-2-yl)formamide?
The InChIKey is PASCIVCCTVXYPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O2S/c12-6-10-8-9-5-7(14-8)11-1-3-13-4-2-11/h5-6H,1-4H2,(H,9,10,12).
What are the key properties of N-(5-morpholin-4-yl-1,3-thiazol-2-yl)formamide?
N-(5-morpholin-4-yl-1,3-thiazol-2-yl)formamide has a molecular weight of 213.26 g/mol, XLogP of 0.55, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-morpholin-4-yl-1,3-thiazol-2-yl)formamide is sourced from PubChem (CID 15398953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).