2-(2,2-dimethylmorpholin-4-yl)-N'-[(2,4-dimethyl-1,3-thiazol-5-yl)methoxy]ethanimidamide

C14H24N4O2S — CID 126803338

IUPAC2-(2,2-dimethylmorpholin-4-yl)-N'-[(2,4-dimethyl-1,3-thiazol-5-yl)methoxy]ethanimidamide
SMILESCc1nc(C)c(CON=C(N)CN2CCOC(C)(C)C2)s1
InChIInChI=1S/C14H24N4O2S/c1-10-12(21-11(2)16-10)8-20-17-13(15)7-18-5-6-19-14(3,4)9-18/h5-9H2,1-4H3,(H2,15,17)
InChIKeyJKBPMXNBKFNFHD-UHFFFAOYSA-N
MW312.44 g/mol
LogP1.66
Rot. Bonds5

About 2-(2,2-dimethylmorpholin-4-yl)-N'-[(2,4-dimethyl-1,3-thiazol-5-yl)methoxy]ethanimidamide

2-(2,2-dimethylmorpholin-4-yl)-N'-[(2,4-dimethyl-1,3-thiazol-5-yl)methoxy]ethanimidamide (PubChem CID 126803338) has the molecular formula C14H24N4O2S and a molecular weight of 312.44 g/mol. Its IUPAC name is 2-(2,2-dimethylmorpholin-4-yl)-N'-[(2,4-dimethyl-1,3-thiazol-5-yl)methoxy]ethanimidamide.

Molecular Properties

Compound Name2-(2,2-dimethylmorpholin-4-yl)-N'-[(2,4-dimethyl-1,3-thiazol-5-yl)methoxy]ethanimidamide
PubChem CID126803338
Molecular FormulaC14H24N4O2S
Molecular Weight312.44 g/mol
Exact Mass312.16
IUPAC Name2-(2,2-dimethylmorpholin-4-yl)-N'-[(2,4-dimethyl-1,3-thiazol-5-yl)methoxy]ethanimidamide
SMILESCc1nc(C)c(CON=C(N)CN2CCOC(C)(C)C2)s1
InChIInChI=1S/C14H24N4O2S/c1-10-12(21-11(2)16-10)8-20-17-13(15)7-18-5-6-19-14(3,4)9-18/h5-9H2,1-4H3,(H2,15,17)
InChIKeyJKBPMXNBKFNFHD-UHFFFAOYSA-N
XLogP1.66
TPSA72.97 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.44
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-(2,2-dimethylmorpholin-4-yl)-N'-[(2,4-dimethyl-1,3-thiazol-5-yl)methoxy]ethanimidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dimethylmorpholin-4-yl)-N'-[(2,4-dimethyl-1,3-thiazol-5-yl)methoxy]ethanimidamide?
The IUPAC name of 2-(2,2-dimethylmorpholin-4-yl)-N'-[(2,4-dimethyl-1,3-thiazol-5-yl)methoxy]ethanimidamide (CID 126803338) is 2-(2,2-dimethylmorpholin-4-yl)-N'-[(2,4-dimethyl-1,3-thiazol-5-yl)methoxy]ethanimidamide.
What is the SMILES notation for 2-(2,2-dimethylmorpholin-4-yl)-N'-[(2,4-dimethyl-1,3-thiazol-5-yl)methoxy]ethanimidamide?
The canonical SMILES for 2-(2,2-dimethylmorpholin-4-yl)-N'-[(2,4-dimethyl-1,3-thiazol-5-yl)methoxy]ethanimidamide is Cc1nc(C)c(CON=C(N)CN2CCOC(C)(C)C2)s1.
What is the InChIKey of 2-(2,2-dimethylmorpholin-4-yl)-N'-[(2,4-dimethyl-1,3-thiazol-5-yl)methoxy]ethanimidamide?
The InChIKey is JKBPMXNBKFNFHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O2S/c1-10-12(21-11(2)16-10)8-20-17-13(15)7-18-5-6-19-14(3,4)9-18/h5-9H2,1-4H3,(H2,15,17).
What are the key properties of 2-(2,2-dimethylmorpholin-4-yl)-N'-[(2,4-dimethyl-1,3-thiazol-5-yl)methoxy]ethanimidamide?
2-(2,2-dimethylmorpholin-4-yl)-N'-[(2,4-dimethyl-1,3-thiazol-5-yl)methoxy]ethanimidamide has a molecular weight of 312.44 g/mol, XLogP of 1.66, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dimethylmorpholin-4-yl)-N'-[(2,4-dimethyl-1,3-thiazol-5-yl)methoxy]ethanimidamide is sourced from PubChem (CID 126803338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).