N-ethyl-4,5-dimethyl-1,3-thiazol-2-amine

C7H12N2S — CID 23074116

IUPACN-ethyl-4,5-dimethyl-1,3-thiazol-2-amine
SMILESCCNc1nc(C)c(C)s1
InChIInChI=1S/C7H12N2S/c1-4-8-7-9-5(2)6(3)10-7/h4H2,1-3H3,(H,8,9)
InChIKeyKDNHTDJMCPSAHQ-UHFFFAOYSA-N
MW156.25 g/mol
LogP2.19
Rot. Bonds2

About N-ethyl-4,5-dimethyl-1,3-thiazol-2-amine

N-ethyl-4,5-dimethyl-1,3-thiazol-2-amine (PubChem CID 23074116) has the molecular formula C7H12N2S and a molecular weight of 156.25 g/mol. Its IUPAC name is N-ethyl-4,5-dimethyl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-ethyl-4,5-dimethyl-1,3-thiazol-2-amine
PubChem CID23074116
Molecular FormulaC7H12N2S
Molecular Weight156.25 g/mol
Exact Mass156.07
IUPAC NameN-ethyl-4,5-dimethyl-1,3-thiazol-2-amine
SMILESCCNc1nc(C)c(C)s1
InChIInChI=1S/C7H12N2S/c1-4-8-7-9-5(2)6(3)10-7/h4H2,1-3H3,(H,8,9)
InChIKeyKDNHTDJMCPSAHQ-UHFFFAOYSA-N
XLogP2.19
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.25
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-4,5-dimethyl-1,3-thiazol-2-amine?
The IUPAC name of N-ethyl-4,5-dimethyl-1,3-thiazol-2-amine (CID 23074116) is N-ethyl-4,5-dimethyl-1,3-thiazol-2-amine.
What is the SMILES notation for N-ethyl-4,5-dimethyl-1,3-thiazol-2-amine?
The canonical SMILES for N-ethyl-4,5-dimethyl-1,3-thiazol-2-amine is CCNc1nc(C)c(C)s1.
What is the InChIKey of N-ethyl-4,5-dimethyl-1,3-thiazol-2-amine?
The InChIKey is KDNHTDJMCPSAHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2S/c1-4-8-7-9-5(2)6(3)10-7/h4H2,1-3H3,(H,8,9).
What are the key properties of N-ethyl-4,5-dimethyl-1,3-thiazol-2-amine?
N-ethyl-4,5-dimethyl-1,3-thiazol-2-amine has a molecular weight of 156.25 g/mol, XLogP of 2.19, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4,5-dimethyl-1,3-thiazol-2-amine is sourced from PubChem (CID 23074116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).