2,5-di(propan-2-yl)-1,3-thiazol-4-amine

C9H16N2S — CID 82373516

IUPAC2,5-di(propan-2-yl)-1,3-thiazol-4-amine
SMILESCC(C)c1nc(N)c(C(C)C)s1
InChIInChI=1S/C9H16N2S/c1-5(2)7-8(10)11-9(12-7)6(3)4/h5-6H,10H2,1-4H3
InChIKeyIHFVQUMQJIAQQC-UHFFFAOYSA-N
MW184.31 g/mol
LogP2.97
Rot. Bonds2

About 2,5-di(propan-2-yl)-1,3-thiazol-4-amine

2,5-di(propan-2-yl)-1,3-thiazol-4-amine (PubChem CID 82373516) has the molecular formula C9H16N2S and a molecular weight of 184.31 g/mol. Its IUPAC name is 2,5-di(propan-2-yl)-1,3-thiazol-4-amine.

Molecular Properties

Compound Name2,5-di(propan-2-yl)-1,3-thiazol-4-amine
PubChem CID82373516
Molecular FormulaC9H16N2S
Molecular Weight184.31 g/mol
Exact Mass184.10
IUPAC Name2,5-di(propan-2-yl)-1,3-thiazol-4-amine
SMILESCC(C)c1nc(N)c(C(C)C)s1
InChIInChI=1S/C9H16N2S/c1-5(2)7-8(10)11-9(12-7)6(3)4/h5-6H,10H2,1-4H3
InChIKeyIHFVQUMQJIAQQC-UHFFFAOYSA-N
XLogP2.97
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.31
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-tert-butyl-2-propan-2-yl-1,3-thiazol-4-amine
CID 163663942
ethane;5-ethyl-2-propan-2-yl-1,3-thiazol-4-amine
CID 170954196
2-propan-2-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-amine
CID 130679895
4,5-dibromo-2-propan-2-yl-1,3-thiazole
CID 66521424
2-propan-2-yl-1,3-benzothiazol-4-amine
CID 83818222
2-propan-2-yl-1,3-benzothiazol-5-amine
CID 69263682
4-heptyl-2-propan-2-yl-1,3-thiazol-5-amine
CID 63469688
2-[1-(4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)ethylamino]ethanol
CID 115707398
2,4-di(propan-2-yl)-1,3-benzothiazole;thiohydroxylamine
CID 19850946
2-propan-2-yl-[1,3]thiazolo[5,4-d]pyrimidine
CID 58470040
(4E,5E)-2-propan-2-yl-4,5-bis(prop-2-enylidene)-1,3-thiazole
CID 176972183
5-heptan-3-yl-2,4-di(propan-2-yl)-1,3-thiazole
CID 177141160

Frequently Asked Questions

What is the IUPAC name of 2,5-di(propan-2-yl)-1,3-thiazol-4-amine?
The IUPAC name of 2,5-di(propan-2-yl)-1,3-thiazol-4-amine (CID 82373516) is 2,5-di(propan-2-yl)-1,3-thiazol-4-amine.
What is the SMILES notation for 2,5-di(propan-2-yl)-1,3-thiazol-4-amine?
The canonical SMILES for 2,5-di(propan-2-yl)-1,3-thiazol-4-amine is CC(C)c1nc(N)c(C(C)C)s1.
What is the InChIKey of 2,5-di(propan-2-yl)-1,3-thiazol-4-amine?
The InChIKey is IHFVQUMQJIAQQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2S/c1-5(2)7-8(10)11-9(12-7)6(3)4/h5-6H,10H2,1-4H3.
What are the key properties of 2,5-di(propan-2-yl)-1,3-thiazol-4-amine?
2,5-di(propan-2-yl)-1,3-thiazol-4-amine has a molecular weight of 184.31 g/mol, XLogP of 2.97, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-di(propan-2-yl)-1,3-thiazol-4-amine is sourced from PubChem (CID 82373516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).