N,N-diethyl-1,3-thiazol-5-amine;ethane

C9H18N2S — CID 142842750

IUPACN,N-diethyl-1,3-thiazol-5-amine;ethane
SMILESCC.CCN(CC)c1cncs1
InChIInChI=1S/C7H12N2S.C2H6/c1-3-9(4-2)7-5-8-6-10-7;1-2/h5-6H,3-4H2,1-2H3;1-2H3
InChIKeyUJWOAEGXGXBBBT-UHFFFAOYSA-N
MW186.32 g/mol
LogP3.02
Rot. Bonds3

About N,N-diethyl-1,3-thiazol-5-amine;ethane

N,N-diethyl-1,3-thiazol-5-amine;ethane (PubChem CID 142842750) has the molecular formula C9H18N2S and a molecular weight of 186.32 g/mol. Its IUPAC name is N,N-diethyl-1,3-thiazol-5-amine;ethane.

Molecular Properties

Compound NameN,N-diethyl-1,3-thiazol-5-amine;ethane
PubChem CID142842750
Molecular FormulaC9H18N2S
Molecular Weight186.32 g/mol
Exact Mass186.12
IUPAC NameN,N-diethyl-1,3-thiazol-5-amine;ethane
SMILESCC.CCN(CC)c1cncs1
InChIInChI=1S/C7H12N2S.C2H6/c1-3-9(4-2)7-5-8-6-10-7;1-2/h5-6H,3-4H2,1-2H3;1-2H3
InChIKeyUJWOAEGXGXBBBT-UHFFFAOYSA-N
XLogP3.02
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.32
LogP ≤ 53.02
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-5-amine;ethane?
The IUPAC name of N,N-diethyl-1,3-thiazol-5-amine;ethane (CID 142842750) is N,N-diethyl-1,3-thiazol-5-amine;ethane.
What is the SMILES notation for N,N-diethyl-1,3-thiazol-5-amine;ethane?
The canonical SMILES for N,N-diethyl-1,3-thiazol-5-amine;ethane is CC.CCN(CC)c1cncs1.
What is the InChIKey of N,N-diethyl-1,3-thiazol-5-amine;ethane?
The InChIKey is UJWOAEGXGXBBBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2S.C2H6/c1-3-9(4-2)7-5-8-6-10-7;1-2/h5-6H,3-4H2,1-2H3;1-2H3.
What are the key properties of N,N-diethyl-1,3-thiazol-5-amine;ethane?
N,N-diethyl-1,3-thiazol-5-amine;ethane has a molecular weight of 186.32 g/mol, XLogP of 3.02, 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-5-amine;ethane is sourced from PubChem (CID 142842750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).