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

C7H12N2S — CID 51898160

IUPAC(1S)-1-(2-ethyl-1,3-thiazol-4-yl)ethanamine
SMILESCCc1nc([C@H](C)N)cs1
InChIInChI=1S/C7H12N2S/c1-3-7-9-6(4-10-7)5(2)8/h4-5H,3,8H2,1-2H3/t5-/m0/s1
InChIKeyBDXVMDPFRXPRNX-YFKPBYRVSA-N
MW156.25 g/mol
LogP1.73
Rot. Bonds2

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

(1S)-1-(2-ethyl-1,3-thiazol-4-yl)ethanamine (PubChem CID 51898160) has the molecular formula C7H12N2S and a molecular weight of 156.25 g/mol. Its IUPAC name is (1S)-1-(2-ethyl-1,3-thiazol-4-yl)ethanamine.

Molecular Properties

Compound Name(1S)-1-(2-ethyl-1,3-thiazol-4-yl)ethanamine
PubChem CID51898160
Molecular FormulaC7H12N2S
Molecular Weight156.25 g/mol
Exact Mass156.07
IUPAC Name(1S)-1-(2-ethyl-1,3-thiazol-4-yl)ethanamine
SMILESCCc1nc([C@H](C)N)cs1
InChIInChI=1S/C7H12N2S/c1-3-7-9-6(4-10-7)5(2)8/h4-5H,3,8H2,1-2H3/t5-/m0/s1
InChIKeyBDXVMDPFRXPRNX-YFKPBYRVSA-N
XLogP1.73
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.25
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethyl-4-(1-iodoethyl)-1,3-thiazole
CID 137495501
1-[2-(2-methylpropyl)-1,3-thiazol-4-yl]ethanamine
CID 64544064
2-[4-(1-aminoethyl)-1,3-thiazol-2-yl]ethanol
CID 115087647
1-[2-(2,2-dimethylpropyl)-1,3-thiazol-4-yl]ethanamine
CID 64543263
N-[1-(2-ethyl-1,3-thiazol-4-yl)ethyl]propan-1-amine
CID 64544094
4-(1-aminoethyl)-1,3-thiazol-2-amine
CID 64545491
1-[2-[(3,5-difluorophenyl)methyl]-1,3-thiazol-4-yl]ethanamine
CID 64544468
1-[2-[(4-methylphenyl)methyl]-1,3-thiazol-4-yl]ethanamine
CID 64545487
methyl 2-[4-(1-aminoethyl)-1,3-thiazol-2-yl]acetate
CID 115021994
3-amino-N-[1-(2-ethyl-1,3-thiazol-4-yl)ethyl]butanamide;dihydrochloride
CID 119886493
N-[1-(2-ethyl-1,3-thiazol-4-yl)ethyl]-3-methoxybutan-2-amine
CID 115718767
1-[2-(piperidin-4-ylmethyl)-1,3-thiazol-4-yl]ethanamine
CID 115088128

Frequently Asked Questions

What is the IUPAC name of (1S)-1-(2-ethyl-1,3-thiazol-4-yl)ethanamine?
The IUPAC name of (1S)-1-(2-ethyl-1,3-thiazol-4-yl)ethanamine (CID 51898160) is (1S)-1-(2-ethyl-1,3-thiazol-4-yl)ethanamine.
What is the SMILES notation for (1S)-1-(2-ethyl-1,3-thiazol-4-yl)ethanamine?
The canonical SMILES for (1S)-1-(2-ethyl-1,3-thiazol-4-yl)ethanamine is CCc1nc([C@H](C)N)cs1.
What is the InChIKey of (1S)-1-(2-ethyl-1,3-thiazol-4-yl)ethanamine?
The InChIKey is BDXVMDPFRXPRNX-YFKPBYRVSA-N. The full InChI is InChI=1S/C7H12N2S/c1-3-7-9-6(4-10-7)5(2)8/h4-5H,3,8H2,1-2H3/t5-/m0/s1.
What are the key properties of (1S)-1-(2-ethyl-1,3-thiazol-4-yl)ethanamine?
(1S)-1-(2-ethyl-1,3-thiazol-4-yl)ethanamine has a molecular weight of 156.25 g/mol, XLogP of 1.73, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-(2-ethyl-1,3-thiazol-4-yl)ethanamine is sourced from PubChem (CID 51898160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).