5-ethyl-N-(pyridin-3-ylmethyl)-1,3-thiazol-2-amine

C11H13N3S — CID 104599802

IUPAC5-ethyl-N-(pyridin-3-ylmethyl)-1,3-thiazol-2-amine
SMILESCCc1cnc(NCc2cccnc2)s1
InChIInChI=1S/C11H13N3S/c1-2-10-8-14-11(15-10)13-7-9-4-3-5-12-6-9/h3-6,8H,2,7H2,1H3,(H,13,14)
InChIKeyFAHZVYSYXJICGZ-UHFFFAOYSA-N
MW219.31 g/mol
LogP2.71
Rot. Bonds4

About 5-ethyl-N-(pyridin-3-ylmethyl)-1,3-thiazol-2-amine

5-ethyl-N-(pyridin-3-ylmethyl)-1,3-thiazol-2-amine (PubChem CID 104599802) has the molecular formula C11H13N3S and a molecular weight of 219.31 g/mol. Its IUPAC name is 5-ethyl-N-(pyridin-3-ylmethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-ethyl-N-(pyridin-3-ylmethyl)-1,3-thiazol-2-amine
PubChem CID104599802
Molecular FormulaC11H13N3S
Molecular Weight219.31 g/mol
Exact Mass219.08
IUPAC Name5-ethyl-N-(pyridin-3-ylmethyl)-1,3-thiazol-2-amine
SMILESCCc1cnc(NCc2cccnc2)s1
InChIInChI=1S/C11H13N3S/c1-2-10-8-14-11(15-10)13-7-9-4-3-5-12-6-9/h3-6,8H,2,7H2,1H3,(H,13,14)
InChIKeyFAHZVYSYXJICGZ-UHFFFAOYSA-N
XLogP2.71
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.31
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-(pyridin-3-ylmethylamino)-1,3-thiazole-5-carboxylate
CID 80572026
5-ethyl-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]-1,3-thiazol-2-amine
CID 86790656
5-ethyl-N-[(1-methylpyrrol-3-yl)methyl]-1,3-thiazol-2-amine
CID 104599771
5-propyl-N-(pyridin-4-ylmethyl)-1,3-thiazol-2-amine
CID 104599847
5-ethyl-N-[(2-fluorophenyl)methyl]-1,3-thiazol-2-amine
CID 104599790
N-[(5-chlorothiophen-2-yl)methyl]-5-ethyl-1,3-thiazol-2-amine
CID 104599768
N-(4-acetamidophenyl)-2-(pyridin-3-ylmethylamino)-1,3-thiazole-5-carboxamide
CID 117085966
5-ethyl-N-propyl-1,3-thiazol-2-amine
CID 62943674
N-(pyridin-3-ylmethyl)pyridin-3-amine
CID 13304847
2-[2-[(4-pyridin-3-ylphenyl)methylamino]-1,3-thiazol-5-yl]acetic acid
CID 174704498
3-ethylpyridine
CID 10823
N-[(2-ethyl-1,3-thiazol-5-yl)methyl]-2-pyridin-3-ylethanamine
CID 54883723

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-(pyridin-3-ylmethyl)-1,3-thiazol-2-amine?
The IUPAC name of 5-ethyl-N-(pyridin-3-ylmethyl)-1,3-thiazol-2-amine (CID 104599802) is 5-ethyl-N-(pyridin-3-ylmethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 5-ethyl-N-(pyridin-3-ylmethyl)-1,3-thiazol-2-amine?
The canonical SMILES for 5-ethyl-N-(pyridin-3-ylmethyl)-1,3-thiazol-2-amine is CCc1cnc(NCc2cccnc2)s1.
What is the InChIKey of 5-ethyl-N-(pyridin-3-ylmethyl)-1,3-thiazol-2-amine?
The InChIKey is FAHZVYSYXJICGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3S/c1-2-10-8-14-11(15-10)13-7-9-4-3-5-12-6-9/h3-6,8H,2,7H2,1H3,(H,13,14).
What are the key properties of 5-ethyl-N-(pyridin-3-ylmethyl)-1,3-thiazol-2-amine?
5-ethyl-N-(pyridin-3-ylmethyl)-1,3-thiazol-2-amine has a molecular weight of 219.31 g/mol, XLogP of 2.71, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-(pyridin-3-ylmethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 104599802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).