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

C6H10N2S — CID 60748054

IUPAC1-(1,3-thiazol-5-yl)propan-2-amine
SMILESCC(N)Cc1cncs1
InChIInChI=1S/C6H10N2S/c1-5(7)2-6-3-8-4-9-6/h3-5H,2,7H2,1H3
InChIKeyGREMNNHAUDTQKY-UHFFFAOYSA-N
MW142.23 g/mol
LogP1.03
Rot. Bonds2

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

1-(1,3-thiazol-5-yl)propan-2-amine (PubChem CID 60748054) has the molecular formula C6H10N2S and a molecular weight of 142.23 g/mol. Its IUPAC name is 1-(1,3-thiazol-5-yl)propan-2-amine.

Molecular Properties

Compound Name1-(1,3-thiazol-5-yl)propan-2-amine
PubChem CID60748054
Molecular FormulaC6H10N2S
Molecular Weight142.23 g/mol
Exact Mass142.06
IUPAC Name1-(1,3-thiazol-5-yl)propan-2-amine
SMILESCC(N)Cc1cncs1
InChIInChI=1S/C6H10N2S/c1-5(7)2-6-3-8-4-9-6/h3-5H,2,7H2,1H3
InChIKeyGREMNNHAUDTQKY-UHFFFAOYSA-N
XLogP1.03
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.23
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1,3-thiazol-5-yl)propan-2-amine?
The IUPAC name of 1-(1,3-thiazol-5-yl)propan-2-amine (CID 60748054) is 1-(1,3-thiazol-5-yl)propan-2-amine.
What is the SMILES notation for 1-(1,3-thiazol-5-yl)propan-2-amine?
The canonical SMILES for 1-(1,3-thiazol-5-yl)propan-2-amine is CC(N)Cc1cncs1.
What is the InChIKey of 1-(1,3-thiazol-5-yl)propan-2-amine?
The InChIKey is GREMNNHAUDTQKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2S/c1-5(7)2-6-3-8-4-9-6/h3-5H,2,7H2,1H3.
What are the key properties of 1-(1,3-thiazol-5-yl)propan-2-amine?
1-(1,3-thiazol-5-yl)propan-2-amine has a molecular weight of 142.23 g/mol, XLogP of 1.03, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-thiazol-5-yl)propan-2-amine is sourced from PubChem (CID 60748054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).