N,N-dimethyl-4-propan-2-yl-1,3-thiazol-2-amine

C8H14N2S — CID 12846789

IUPACN,N-dimethyl-4-propan-2-yl-1,3-thiazol-2-amine
SMILESCC(C)c1csc(N(C)C)n1
InChIInChI=1S/C8H14N2S/c1-6(2)7-5-11-8(9-7)10(3)4/h5-6H,1-4H3
InChIKeyQRYOBASSRUOZQP-UHFFFAOYSA-N
MW170.28 g/mol
LogP2.33
Rot. Bonds2

About N,N-dimethyl-4-propan-2-yl-1,3-thiazol-2-amine

N,N-dimethyl-4-propan-2-yl-1,3-thiazol-2-amine (PubChem CID 12846789) has the molecular formula C8H14N2S and a molecular weight of 170.28 g/mol. Its IUPAC name is N,N-dimethyl-4-propan-2-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN,N-dimethyl-4-propan-2-yl-1,3-thiazol-2-amine
PubChem CID12846789
Molecular FormulaC8H14N2S
Molecular Weight170.28 g/mol
Exact Mass170.09
IUPAC NameN,N-dimethyl-4-propan-2-yl-1,3-thiazol-2-amine
SMILESCC(C)c1csc(N(C)C)n1
InChIInChI=1S/C8H14N2S/c1-6(2)7-5-11-8(9-7)10(3)4/h5-6H,1-4H3
InChIKeyQRYOBASSRUOZQP-UHFFFAOYSA-N
XLogP2.33
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.28
LogP ≤ 52.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-propan-2-yl-1,3-thiazol-2-amine?
The IUPAC name of N,N-dimethyl-4-propan-2-yl-1,3-thiazol-2-amine (CID 12846789) is N,N-dimethyl-4-propan-2-yl-1,3-thiazol-2-amine.
What is the SMILES notation for N,N-dimethyl-4-propan-2-yl-1,3-thiazol-2-amine?
The canonical SMILES for N,N-dimethyl-4-propan-2-yl-1,3-thiazol-2-amine is CC(C)c1csc(N(C)C)n1.
What is the InChIKey of N,N-dimethyl-4-propan-2-yl-1,3-thiazol-2-amine?
The InChIKey is QRYOBASSRUOZQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2S/c1-6(2)7-5-11-8(9-7)10(3)4/h5-6H,1-4H3.
What are the key properties of N,N-dimethyl-4-propan-2-yl-1,3-thiazol-2-amine?
N,N-dimethyl-4-propan-2-yl-1,3-thiazol-2-amine has a molecular weight of 170.28 g/mol, XLogP of 2.33, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-propan-2-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 12846789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).