N-(azetidin-3-yl)-N,4,5-trimethyl-1,3-thiazol-2-amine

C9H15N3S — CID 66184404

IUPACN-(azetidin-3-yl)-N,4,5-trimethyl-1,3-thiazol-2-amine
SMILESCc1nc(N(C)C2CNC2)sc1C
InChIInChI=1S/C9H15N3S/c1-6-7(2)13-9(11-6)12(3)8-4-10-5-8/h8,10H,4-5H2,1-3H3
InChIKeyIEIFZGRMTHUCNG-UHFFFAOYSA-N
MW197.31 g/mol
LogP1.17
Rot. Bonds2

About N-(azetidin-3-yl)-N,4,5-trimethyl-1,3-thiazol-2-amine

N-(azetidin-3-yl)-N,4,5-trimethyl-1,3-thiazol-2-amine (PubChem CID 66184404) has the molecular formula C9H15N3S and a molecular weight of 197.31 g/mol. Its IUPAC name is N-(azetidin-3-yl)-N,4,5-trimethyl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(azetidin-3-yl)-N,4,5-trimethyl-1,3-thiazol-2-amine
PubChem CID66184404
Molecular FormulaC9H15N3S
Molecular Weight197.31 g/mol
Exact Mass197.10
IUPAC NameN-(azetidin-3-yl)-N,4,5-trimethyl-1,3-thiazol-2-amine
SMILESCc1nc(N(C)C2CNC2)sc1C
InChIInChI=1S/C9H15N3S/c1-6-7(2)13-9(11-6)12(3)8-4-10-5-8/h8,10H,4-5H2,1-3H3
InChIKeyIEIFZGRMTHUCNG-UHFFFAOYSA-N
XLogP1.17
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.31
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(azetidin-3-yl)-N,4,5-trimethyl-1,3-thiazol-2-amine?
The IUPAC name of N-(azetidin-3-yl)-N,4,5-trimethyl-1,3-thiazol-2-amine (CID 66184404) is N-(azetidin-3-yl)-N,4,5-trimethyl-1,3-thiazol-2-amine.
What is the SMILES notation for N-(azetidin-3-yl)-N,4,5-trimethyl-1,3-thiazol-2-amine?
The canonical SMILES for N-(azetidin-3-yl)-N,4,5-trimethyl-1,3-thiazol-2-amine is Cc1nc(N(C)C2CNC2)sc1C.
What is the InChIKey of N-(azetidin-3-yl)-N,4,5-trimethyl-1,3-thiazol-2-amine?
The InChIKey is IEIFZGRMTHUCNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3S/c1-6-7(2)13-9(11-6)12(3)8-4-10-5-8/h8,10H,4-5H2,1-3H3.
What are the key properties of N-(azetidin-3-yl)-N,4,5-trimethyl-1,3-thiazol-2-amine?
N-(azetidin-3-yl)-N,4,5-trimethyl-1,3-thiazol-2-amine has a molecular weight of 197.31 g/mol, XLogP of 1.17, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(azetidin-3-yl)-N,4,5-trimethyl-1,3-thiazol-2-amine is sourced from PubChem (CID 66184404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).