5-(ethylaminomethyl)-N,4-dimethyl-N-(oxan-2-ylmethyl)-1,3-thiazol-2-amine

C14H25N3OS — CID 55117371

IUPAC5-(ethylaminomethyl)-N,4-dimethyl-N-(oxan-2-ylmethyl)-1,3-thiazol-2-amine
SMILESCCNCc1sc(N(C)CC2CCCCO2)nc1C
InChIInChI=1S/C14H25N3OS/c1-4-15-9-13-11(2)16-14(19-13)17(3)10-12-7-5-6-8-18-12/h12,15H,4-10H2,1-3H3
InChIKeySYWMFQREGRIYSK-UHFFFAOYSA-N
MW283.44 g/mol
LogP2.57
Rot. Bonds6

About 5-(ethylaminomethyl)-N,4-dimethyl-N-(oxan-2-ylmethyl)-1,3-thiazol-2-amine

5-(ethylaminomethyl)-N,4-dimethyl-N-(oxan-2-ylmethyl)-1,3-thiazol-2-amine (PubChem CID 55117371) has the molecular formula C14H25N3OS and a molecular weight of 283.44 g/mol. Its IUPAC name is 5-(ethylaminomethyl)-N,4-dimethyl-N-(oxan-2-ylmethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(ethylaminomethyl)-N,4-dimethyl-N-(oxan-2-ylmethyl)-1,3-thiazol-2-amine
PubChem CID55117371
Molecular FormulaC14H25N3OS
Molecular Weight283.44 g/mol
Exact Mass283.17
IUPAC Name5-(ethylaminomethyl)-N,4-dimethyl-N-(oxan-2-ylmethyl)-1,3-thiazol-2-amine
SMILESCCNCc1sc(N(C)CC2CCCCO2)nc1C
InChIInChI=1S/C14H25N3OS/c1-4-15-9-13-11(2)16-14(19-13)17(3)10-12-7-5-6-8-18-12/h12,15H,4-10H2,1-3H3
InChIKeySYWMFQREGRIYSK-UHFFFAOYSA-N
XLogP2.57
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.44
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-(ethylaminomethyl)-N,4-dimethyl-N-(oxan-2-ylmethyl)-1,3-thiazol-2-amine 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 5-(ethylaminomethyl)-N,4-dimethyl-N-(oxan-2-ylmethyl)-1,3-thiazol-2-amine?
The IUPAC name of 5-(ethylaminomethyl)-N,4-dimethyl-N-(oxan-2-ylmethyl)-1,3-thiazol-2-amine (CID 55117371) is 5-(ethylaminomethyl)-N,4-dimethyl-N-(oxan-2-ylmethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(ethylaminomethyl)-N,4-dimethyl-N-(oxan-2-ylmethyl)-1,3-thiazol-2-amine?
The canonical SMILES for 5-(ethylaminomethyl)-N,4-dimethyl-N-(oxan-2-ylmethyl)-1,3-thiazol-2-amine is CCNCc1sc(N(C)CC2CCCCO2)nc1C.
What is the InChIKey of 5-(ethylaminomethyl)-N,4-dimethyl-N-(oxan-2-ylmethyl)-1,3-thiazol-2-amine?
The InChIKey is SYWMFQREGRIYSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3OS/c1-4-15-9-13-11(2)16-14(19-13)17(3)10-12-7-5-6-8-18-12/h12,15H,4-10H2,1-3H3.
What are the key properties of 5-(ethylaminomethyl)-N,4-dimethyl-N-(oxan-2-ylmethyl)-1,3-thiazol-2-amine?
5-(ethylaminomethyl)-N,4-dimethyl-N-(oxan-2-ylmethyl)-1,3-thiazol-2-amine has a molecular weight of 283.44 g/mol, XLogP of 2.57, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylaminomethyl)-N,4-dimethyl-N-(oxan-2-ylmethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 55117371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).