(2-ethyl-1,3-thiazol-5-yl)methanamine

C6H10N2S — CID 60983127

IUPAC(2-ethyl-1,3-thiazol-5-yl)methanamine
SMILESCCc1ncc(CN)s1
InChIInChI=1S/C6H10N2S/c1-2-6-8-4-5(3-7)9-6/h4H,2-3,7H2,1H3
InChIKeyVVGHFFICVOVLNB-UHFFFAOYSA-N
MW142.23 g/mol
LogP1.16
Rot. Bonds2

About (2-ethyl-1,3-thiazol-5-yl)methanamine

(2-ethyl-1,3-thiazol-5-yl)methanamine (PubChem CID 60983127) has the molecular formula C6H10N2S and a molecular weight of 142.23 g/mol. Its IUPAC name is (2-ethyl-1,3-thiazol-5-yl)methanamine.

Molecular Properties

Compound Name(2-ethyl-1,3-thiazol-5-yl)methanamine
PubChem CID60983127
Molecular FormulaC6H10N2S
Molecular Weight142.23 g/mol
Exact Mass142.06
IUPAC Name(2-ethyl-1,3-thiazol-5-yl)methanamine
SMILESCCc1ncc(CN)s1
InChIInChI=1S/C6H10N2S/c1-2-6-8-4-5(3-7)9-6/h4H,2-3,7H2,1H3
InChIKeyVVGHFFICVOVLNB-UHFFFAOYSA-N
XLogP1.16
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 ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2-ethyl-1,3-thiazol-5-yl)methanamine?
The IUPAC name of (2-ethyl-1,3-thiazol-5-yl)methanamine (CID 60983127) is (2-ethyl-1,3-thiazol-5-yl)methanamine.
What is the SMILES notation for (2-ethyl-1,3-thiazol-5-yl)methanamine?
The canonical SMILES for (2-ethyl-1,3-thiazol-5-yl)methanamine is CCc1ncc(CN)s1.
What is the InChIKey of (2-ethyl-1,3-thiazol-5-yl)methanamine?
The InChIKey is VVGHFFICVOVLNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2S/c1-2-6-8-4-5(3-7)9-6/h4H,2-3,7H2,1H3.
What are the key properties of (2-ethyl-1,3-thiazol-5-yl)methanamine?
(2-ethyl-1,3-thiazol-5-yl)methanamine has a molecular weight of 142.23 g/mol, XLogP of 1.16, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethyl-1,3-thiazol-5-yl)methanamine is sourced from PubChem (CID 60983127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).