5-[(tert-butylamino)methyl]-N,N-dimethyl-1,3-thiazol-2-amine

C10H19N3S — CID 61037566

IUPAC5-[(tert-butylamino)methyl]-N,N-dimethyl-1,3-thiazol-2-amine
SMILESCN(C)c1ncc(CNC(C)(C)C)s1
InChIInChI=1S/C10H19N3S/c1-10(2,3)12-7-8-6-11-9(14-8)13(4)5/h6,12H,7H2,1-5H3
InChIKeyQFFZQOIZLHERTE-UHFFFAOYSA-N
MW213.35 g/mol
LogP2.10
Rot. Bonds3

About 5-[(tert-butylamino)methyl]-N,N-dimethyl-1,3-thiazol-2-amine

5-[(tert-butylamino)methyl]-N,N-dimethyl-1,3-thiazol-2-amine (PubChem CID 61037566) has the molecular formula C10H19N3S and a molecular weight of 213.35 g/mol. Its IUPAC name is 5-[(tert-butylamino)methyl]-N,N-dimethyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-[(tert-butylamino)methyl]-N,N-dimethyl-1,3-thiazol-2-amine
PubChem CID61037566
Molecular FormulaC10H19N3S
Molecular Weight213.35 g/mol
Exact Mass213.13
IUPAC Name5-[(tert-butylamino)methyl]-N,N-dimethyl-1,3-thiazol-2-amine
SMILESCN(C)c1ncc(CNC(C)(C)C)s1
InChIInChI=1S/C10H19N3S/c1-10(2,3)12-7-8-6-11-9(14-8)13(4)5/h6,12H,7H2,1-5H3
InChIKeyQFFZQOIZLHERTE-UHFFFAOYSA-N
XLogP2.10
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.35
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[(tert-butylamino)methyl]-N,N-dimethyl-1,3-thiazol-2-amine?
The IUPAC name of 5-[(tert-butylamino)methyl]-N,N-dimethyl-1,3-thiazol-2-amine (CID 61037566) is 5-[(tert-butylamino)methyl]-N,N-dimethyl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-[(tert-butylamino)methyl]-N,N-dimethyl-1,3-thiazol-2-amine?
The canonical SMILES for 5-[(tert-butylamino)methyl]-N,N-dimethyl-1,3-thiazol-2-amine is CN(C)c1ncc(CNC(C)(C)C)s1.
What is the InChIKey of 5-[(tert-butylamino)methyl]-N,N-dimethyl-1,3-thiazol-2-amine?
The InChIKey is QFFZQOIZLHERTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3S/c1-10(2,3)12-7-8-6-11-9(14-8)13(4)5/h6,12H,7H2,1-5H3.
What are the key properties of 5-[(tert-butylamino)methyl]-N,N-dimethyl-1,3-thiazol-2-amine?
5-[(tert-butylamino)methyl]-N,N-dimethyl-1,3-thiazol-2-amine has a molecular weight of 213.35 g/mol, XLogP of 2.10, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(tert-butylamino)methyl]-N,N-dimethyl-1,3-thiazol-2-amine is sourced from PubChem (CID 61037566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).