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

C6H10N2S — CID 82417946

IUPAC3-(1,2-thiazol-3-yl)propan-1-amine
SMILESNCCCc1ccsn1
InChIInChI=1S/C6H10N2S/c7-4-1-2-6-3-5-9-8-6/h3,5H,1-2,4,7H2
InChIKeyIHHHFMPMKJMFEG-UHFFFAOYSA-N
MW142.23 g/mol
LogP1.03
Rot. Bonds3

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

3-(1,2-thiazol-3-yl)propan-1-amine (PubChem CID 82417946) has the molecular formula C6H10N2S and a molecular weight of 142.23 g/mol. Its IUPAC name is 3-(1,2-thiazol-3-yl)propan-1-amine.

Molecular Properties

Compound Name3-(1,2-thiazol-3-yl)propan-1-amine
PubChem CID82417946
Molecular FormulaC6H10N2S
Molecular Weight142.23 g/mol
Exact Mass142.06
IUPAC Name3-(1,2-thiazol-3-yl)propan-1-amine
SMILESNCCCc1ccsn1
InChIInChI=1S/C6H10N2S/c7-4-1-2-6-3-5-9-8-6/h3,5H,1-2,4,7H2
InChIKeyIHHHFMPMKJMFEG-UHFFFAOYSA-N
XLogP1.03
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
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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Related Compounds

4-Fluoro-4-(1,2-thiazol-3-yl)cyclohexan-1-amine
CID 126985698
3-Fluoro-3-(1,2-thiazol-3-yl)propan-1-amine
CID 126985742
4-Fluoro-2-methyl-4-(1,2-thiazol-3-yl)butan-2-amine
CID 127004475
3,3,3-Trifluoro-1-(1,2-thiazol-3-yl)propan-1-amine
CID 130632421
3-Fluoro-3-(1,2-thiazol-3-yl)cyclohexan-1-amine
CID 130706404
3-Fluoro-2-methyl-3-(1,2-thiazol-3-yl)propan-1-amine
CID 130969790
2-Fluoro-2-(1,2-thiazol-3-yl)butan-1-amine
CID 133630044
3-Fluoro-3-(1,2-thiazol-3-yl)butan-2-amine
CID 133677658
3-Ethyl-1,2-thiazole
CID 14343599
3-Propyl-1,2-thiazole
CID 14343600
2-(1,2-Thiazol-3-yl)ethanethioamide
CID 20187103
3-Butyl-1,2-thiazole
CID 20467538

Frequently Asked Questions

What is the IUPAC name of 3-(1,2-thiazol-3-yl)propan-1-amine?
The IUPAC name of 3-(1,2-thiazol-3-yl)propan-1-amine (CID 82417946) is 3-(1,2-thiazol-3-yl)propan-1-amine.
What is the SMILES notation for 3-(1,2-thiazol-3-yl)propan-1-amine?
The canonical SMILES for 3-(1,2-thiazol-3-yl)propan-1-amine is NCCCc1ccsn1.
What is the InChIKey of 3-(1,2-thiazol-3-yl)propan-1-amine?
The InChIKey is IHHHFMPMKJMFEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2S/c7-4-1-2-6-3-5-9-8-6/h3,5H,1-2,4,7H2.
What are the key properties of 3-(1,2-thiazol-3-yl)propan-1-amine?
3-(1,2-thiazol-3-yl)propan-1-amine has a molecular weight of 142.23 g/mol, XLogP of 1.03, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,2-thiazol-3-yl)propan-1-amine is sourced from PubChem (CID 82417946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).