(1S)-1-(5-ethyl-4-methyl-1,3-thiazol-2-yl)ethanamine

C8H14N2S — CID 82668357

IUPAC(1S)-1-(5-ethyl-4-methyl-1,3-thiazol-2-yl)ethanamine
SMILESCCc1sc([C@H](C)N)nc1C
InChIInChI=1S/C8H14N2S/c1-4-7-6(3)10-8(11-7)5(2)9/h5H,4,9H2,1-3H3/t5-/m0/s1
InChIKeyFWZJMTMMXMULKC-YFKPBYRVSA-N
MW170.28 g/mol
LogP2.03
Rot. Bonds2

About (1S)-1-(5-ethyl-4-methyl-1,3-thiazol-2-yl)ethanamine

(1S)-1-(5-ethyl-4-methyl-1,3-thiazol-2-yl)ethanamine (PubChem CID 82668357) has the molecular formula C8H14N2S and a molecular weight of 170.28 g/mol. Its IUPAC name is (1S)-1-(5-ethyl-4-methyl-1,3-thiazol-2-yl)ethanamine.

Molecular Properties

Compound Name(1S)-1-(5-ethyl-4-methyl-1,3-thiazol-2-yl)ethanamine
PubChem CID82668357
Molecular FormulaC8H14N2S
Molecular Weight170.28 g/mol
Exact Mass170.09
IUPAC Name(1S)-1-(5-ethyl-4-methyl-1,3-thiazol-2-yl)ethanamine
SMILESCCc1sc([C@H](C)N)nc1C
InChIInChI=1S/C8H14N2S/c1-4-7-6(3)10-8(11-7)5(2)9/h5H,4,9H2,1-3H3/t5-/m0/s1
InChIKeyFWZJMTMMXMULKC-YFKPBYRVSA-N
XLogP2.03
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.28
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 2-(1-aminoethyl)-4-methyl-1,3-thiazole-5-carboxylate;hydrochloride
CID 146082192
1-[4-bromo-5-(2-methylpropyl)-1,3-thiazol-2-yl]ethanamine
CID 83693661
(1R)-1-(4-ethyl-1,3-thiazol-2-yl)ethanamine
CID 42077975
ethane;5-ethyl-2-propan-2-yl-1,3-thiazol-4-amine
CID 170954196
[2-(1-ethoxy-2-methylpropyl)-4-methyl-1,3-thiazol-5-yl]methanamine
CID 116730526
1-[4-bromo-5-(methoxymethyl)-1,3-thiazol-2-yl]ethanamine
CID 83693258
N-[(4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)methyl]propan-1-amine
CID 62403726
3-(4,5-dimethyl-1,3-thiazol-2-yl)pentan-2-amine
CID 65169091
3-(4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)propan-1-ol
CID 116885395
5-ethyl-2-(methoxymethyl)-4-methyl-1,3-thiazole
CID 129301399
5-(1-aminoethyl)-N-ethyl-N,4-dimethyl-1,3-thiazol-2-amine
CID 62752198
1-(5-ethyl-4-methylthiophen-2-yl)ethanamine;hydrochloride
CID 71757020

Frequently Asked Questions

What is the IUPAC name of (1S)-1-(5-ethyl-4-methyl-1,3-thiazol-2-yl)ethanamine?
The IUPAC name of (1S)-1-(5-ethyl-4-methyl-1,3-thiazol-2-yl)ethanamine (CID 82668357) is (1S)-1-(5-ethyl-4-methyl-1,3-thiazol-2-yl)ethanamine.
What is the SMILES notation for (1S)-1-(5-ethyl-4-methyl-1,3-thiazol-2-yl)ethanamine?
The canonical SMILES for (1S)-1-(5-ethyl-4-methyl-1,3-thiazol-2-yl)ethanamine is CCc1sc([C@H](C)N)nc1C.
What is the InChIKey of (1S)-1-(5-ethyl-4-methyl-1,3-thiazol-2-yl)ethanamine?
The InChIKey is FWZJMTMMXMULKC-YFKPBYRVSA-N. The full InChI is InChI=1S/C8H14N2S/c1-4-7-6(3)10-8(11-7)5(2)9/h5H,4,9H2,1-3H3/t5-/m0/s1.
What are the key properties of (1S)-1-(5-ethyl-4-methyl-1,3-thiazol-2-yl)ethanamine?
(1S)-1-(5-ethyl-4-methyl-1,3-thiazol-2-yl)ethanamine has a molecular weight of 170.28 g/mol, XLogP of 2.03, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-(5-ethyl-4-methyl-1,3-thiazol-2-yl)ethanamine is sourced from PubChem (CID 82668357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).