(2R)-N,N-dimethyl-4-(1,3-thiazol-2-yloxy)butan-2-amine

C9H16N2OS — CID 71716730

IUPAC(2R)-N,N-dimethyl-4-(1,3-thiazol-2-yloxy)butan-2-amine
SMILESC[C@H](CCOc1nccs1)N(C)C
InChIInChI=1S/C9H16N2OS/c1-8(11(2)3)4-6-12-9-10-5-7-13-9/h5,7-8H,4,6H2,1-3H3/t8-/m1/s1
InChIKeyYQLLVKHAIUKIIW-MRVPVSSYSA-N
MW200.31 g/mol
LogP1.86
Rot. Bonds5

About (2R)-N,N-dimethyl-4-(1,3-thiazol-2-yloxy)butan-2-amine

(2R)-N,N-dimethyl-4-(1,3-thiazol-2-yloxy)butan-2-amine (PubChem CID 71716730) has the molecular formula C9H16N2OS and a molecular weight of 200.31 g/mol. Its IUPAC name is (2R)-N,N-dimethyl-4-(1,3-thiazol-2-yloxy)butan-2-amine.

Molecular Properties

Compound Name(2R)-N,N-dimethyl-4-(1,3-thiazol-2-yloxy)butan-2-amine
PubChem CID71716730
Molecular FormulaC9H16N2OS
Molecular Weight200.31 g/mol
Exact Mass200.10
IUPAC Name(2R)-N,N-dimethyl-4-(1,3-thiazol-2-yloxy)butan-2-amine
SMILESC[C@H](CCOc1nccs1)N(C)C
InChIInChI=1S/C9H16N2OS/c1-8(11(2)3)4-6-12-9-10-5-7-13-9/h5,7-8H,4,6H2,1-3H3/t8-/m1/s1
InChIKeyYQLLVKHAIUKIIW-MRVPVSSYSA-N
XLogP1.86
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.31
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (2R)-N,N-dimethyl-4-(1,3-thiazol-2-yloxy)butan-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

Related Compounds

2-Ethoxythiazole
CID 61809
[3-(dimethylamino)-4-(1,3-thiazol-2-yloxy)butyl] N,N-dimethylcarbamate
CID 122189557
2-Butoxy-1,3-thiazole
CID 22406947
2-[[(2R)-1-methylpiperidin-2-yl]methoxy]-1,3-thiazole
CID 164631730
2-Pent-4-ynoxy-1,3-thiazole
CID 176427342
2-(Octyloxy)thiazole
CID 44154747
2-Isopropoxythiazole
CID 21334097
Ethoxyethane;1,3-thiazole
CID 23459377
2-[5,5,5-Tris(methylsulfanyl)pentoxy]-1,3-thiazole
CID 54237128
2-[2,2,2-Tris(methylsulfanyl)ethoxy]-1,3-thiazole
CID 54478310
2-Propoxy-1,3-thiazole
CID 59113532
2-(2-Methylpropoxy)-1,3-thiazole
CID 59202159

Frequently Asked Questions

What is the IUPAC name of (2R)-N,N-dimethyl-4-(1,3-thiazol-2-yloxy)butan-2-amine?
The IUPAC name of (2R)-N,N-dimethyl-4-(1,3-thiazol-2-yloxy)butan-2-amine (CID 71716730) is (2R)-N,N-dimethyl-4-(1,3-thiazol-2-yloxy)butan-2-amine.
What is the SMILES notation for (2R)-N,N-dimethyl-4-(1,3-thiazol-2-yloxy)butan-2-amine?
The canonical SMILES for (2R)-N,N-dimethyl-4-(1,3-thiazol-2-yloxy)butan-2-amine is C[C@H](CCOc1nccs1)N(C)C.
What is the InChIKey of (2R)-N,N-dimethyl-4-(1,3-thiazol-2-yloxy)butan-2-amine?
The InChIKey is YQLLVKHAIUKIIW-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H16N2OS/c1-8(11(2)3)4-6-12-9-10-5-7-13-9/h5,7-8H,4,6H2,1-3H3/t8-/m1/s1.
What are the key properties of (2R)-N,N-dimethyl-4-(1,3-thiazol-2-yloxy)butan-2-amine?
(2R)-N,N-dimethyl-4-(1,3-thiazol-2-yloxy)butan-2-amine has a molecular weight of 200.31 g/mol, XLogP of 1.86, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N,N-dimethyl-4-(1,3-thiazol-2-yloxy)butan-2-amine is sourced from PubChem (CID 71716730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).