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

C8H14N2S — CID 131088967

IUPAC2,2-dimethyl-1-(1,2-thiazol-3-yl)propan-1-amine
SMILESCC(C)(C)C(N)c1ccsn1
InChIInChI=1S/C8H14N2S/c1-8(2,3)7(9)6-4-5-11-10-6/h4-5,7H,9H2,1-3H3
InChIKeyYEMWUZHEMDGJOD-UHFFFAOYSA-N
MW170.28 g/mol
LogP2.19
Rot. Bonds1

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

2,2-dimethyl-1-(1,2-thiazol-3-yl)propan-1-amine (PubChem CID 131088967) has the molecular formula C8H14N2S and a molecular weight of 170.28 g/mol. Its IUPAC name is 2,2-dimethyl-1-(1,2-thiazol-3-yl)propan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-1-(1,2-thiazol-3-yl)propan-1-amine
PubChem CID131088967
Molecular FormulaC8H14N2S
Molecular Weight170.28 g/mol
Exact Mass170.09
IUPAC Name2,2-dimethyl-1-(1,2-thiazol-3-yl)propan-1-amine
SMILESCC(C)(C)C(N)c1ccsn1
InChIInChI=1S/C8H14N2S/c1-8(2,3)7(9)6-4-5-11-10-6/h4-5,7H,9H2,1-3H3
InChIKeyYEMWUZHEMDGJOD-UHFFFAOYSA-N
XLogP2.19
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.28
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,2,2-trimethyl-1-(1,2-thiazol-3-yl)propan-1-amine
CID 130667241
4-fluoro-2-methyl-4-(1,2-thiazol-3-yl)butan-2-amine
CID 127004475
(1S,2R)-2-amino-4-methyl-1-(1,2-thiazol-3-yl)pentan-1-ol
CID 70041804
3-(1-chloroethyl)-1,2-thiazole
CID 130920926
2,2-dimethyl-1-(1,2-thiazol-3-yl)butan-1-ol
CID 130727781
3-pentan-3-yl-1,2-thiazole
CID 170381206
3-(1,2-thiazol-3-yl)butan-1-amine
CID 126985785
1-(1,2-thiazol-3-yl)propane-1,2-diol
CID 130604797
1-(1,2-thiazol-3-yl)but-3-en-1-amine
CID 130632089
(3-methyl-4-pyridinyl)-(1,2-thiazol-3-yl)methanamine
CID 130713034
3-amino-1-(1,2-thiazol-3-yl)propane-1-thiol
CID 57258567
(5-chloro-2-pyridinyl)-(1,2-thiazol-3-yl)methanamine
CID 130731616

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-1-(1,2-thiazol-3-yl)propan-1-amine?
The IUPAC name of 2,2-dimethyl-1-(1,2-thiazol-3-yl)propan-1-amine (CID 131088967) is 2,2-dimethyl-1-(1,2-thiazol-3-yl)propan-1-amine.
What is the SMILES notation for 2,2-dimethyl-1-(1,2-thiazol-3-yl)propan-1-amine?
The canonical SMILES for 2,2-dimethyl-1-(1,2-thiazol-3-yl)propan-1-amine is CC(C)(C)C(N)c1ccsn1.
What is the InChIKey of 2,2-dimethyl-1-(1,2-thiazol-3-yl)propan-1-amine?
The InChIKey is YEMWUZHEMDGJOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2S/c1-8(2,3)7(9)6-4-5-11-10-6/h4-5,7H,9H2,1-3H3.
What are the key properties of 2,2-dimethyl-1-(1,2-thiazol-3-yl)propan-1-amine?
2,2-dimethyl-1-(1,2-thiazol-3-yl)propan-1-amine has a molecular weight of 170.28 g/mol, XLogP of 2.19, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-1-(1,2-thiazol-3-yl)propan-1-amine is sourced from PubChem (CID 131088967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).