N,N-diethyl-4-methyl-1,3-thiazol-2-amine

C8H14N2S — CID 2530295

IUPACN,N-diethyl-4-methyl-1,3-thiazol-2-amine
SMILESCCN(CC)c1nc(C)cs1
InChIInChI=1S/C8H14N2S/c1-4-10(5-2)8-9-7(3)6-11-8/h6H,4-5H2,1-3H3
InChIKeyXILGXBZRDDESBW-UHFFFAOYSA-N
MW170.28 g/mol
LogP2.30
Rot. Bonds3

About N,N-diethyl-4-methyl-1,3-thiazol-2-amine

N,N-diethyl-4-methyl-1,3-thiazol-2-amine (PubChem CID 2530295) has the molecular formula C8H14N2S and a molecular weight of 170.28 g/mol. Its IUPAC name is N,N-diethyl-4-methyl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN,N-diethyl-4-methyl-1,3-thiazol-2-amine
PubChem CID2530295
Molecular FormulaC8H14N2S
Molecular Weight170.28 g/mol
Exact Mass170.09
IUPAC NameN,N-diethyl-4-methyl-1,3-thiazol-2-amine
SMILESCCN(CC)c1nc(C)cs1
InChIInChI=1S/C8H14N2S/c1-4-10(5-2)8-9-7(3)6-11-8/h6H,4-5H2,1-3H3
InChIKeyXILGXBZRDDESBW-UHFFFAOYSA-N
XLogP2.30
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.28
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-4-methyl-1,3-thiazol-2-amine?
The IUPAC name of N,N-diethyl-4-methyl-1,3-thiazol-2-amine (CID 2530295) is N,N-diethyl-4-methyl-1,3-thiazol-2-amine.
What is the SMILES notation for N,N-diethyl-4-methyl-1,3-thiazol-2-amine?
The canonical SMILES for N,N-diethyl-4-methyl-1,3-thiazol-2-amine is CCN(CC)c1nc(C)cs1.
What is the InChIKey of N,N-diethyl-4-methyl-1,3-thiazol-2-amine?
The InChIKey is XILGXBZRDDESBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2S/c1-4-10(5-2)8-9-7(3)6-11-8/h6H,4-5H2,1-3H3.
What are the key properties of N,N-diethyl-4-methyl-1,3-thiazol-2-amine?
N,N-diethyl-4-methyl-1,3-thiazol-2-amine has a molecular weight of 170.28 g/mol, XLogP of 2.30, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-4-methyl-1,3-thiazol-2-amine is sourced from PubChem (CID 2530295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).