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

C7H12N2S — CID 2530298

IUPACN,N-diethyl-1,3-thiazol-2-amine
SMILESCCN(CC)c1nccs1
InChIInChI=1S/C7H12N2S/c1-3-9(4-2)7-8-5-6-10-7/h5-6H,3-4H2,1-2H3
InChIKeyFMPDLFJFQAPPGK-UHFFFAOYSA-N
MW156.25 g/mol
LogP1.99
Rot. Bonds3

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

N,N-diethyl-1,3-thiazol-2-amine (PubChem CID 2530298) has the molecular formula C7H12N2S and a molecular weight of 156.25 g/mol. Its IUPAC name is N,N-diethyl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN,N-diethyl-1,3-thiazol-2-amine
PubChem CID2530298
Molecular FormulaC7H12N2S
Molecular Weight156.25 g/mol
Exact Mass156.07
IUPAC NameN,N-diethyl-1,3-thiazol-2-amine
SMILESCCN(CC)c1nccs1
InChIInChI=1S/C7H12N2S/c1-3-9(4-2)7-8-5-6-10-7/h5-6H,3-4H2,1-2H3
InChIKeyFMPDLFJFQAPPGK-UHFFFAOYSA-N
XLogP1.99
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.25
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-1,3-thiazol-2-amine?
The IUPAC name of N,N-diethyl-1,3-thiazol-2-amine (CID 2530298) is N,N-diethyl-1,3-thiazol-2-amine.
What is the SMILES notation for N,N-diethyl-1,3-thiazol-2-amine?
The canonical SMILES for N,N-diethyl-1,3-thiazol-2-amine is CCN(CC)c1nccs1.
What is the InChIKey of N,N-diethyl-1,3-thiazol-2-amine?
The InChIKey is FMPDLFJFQAPPGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2S/c1-3-9(4-2)7-8-5-6-10-7/h5-6H,3-4H2,1-2H3.
What are the key properties of N,N-diethyl-1,3-thiazol-2-amine?
N,N-diethyl-1,3-thiazol-2-amine has a molecular weight of 156.25 g/mol, XLogP of 1.99, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-1,3-thiazol-2-amine is sourced from PubChem (CID 2530298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).