2-N-(1-pyridin-3-ylethyl)-1,3-thiazole-2,5-diamine

C10H12N4S — CID 102767611

IUPAC2-N-(1-pyridin-3-ylethyl)-1,3-thiazole-2,5-diamine
SMILESCC(Nc1ncc(N)s1)c1cccnc1
InChIInChI=1S/C10H12N4S/c1-7(8-3-2-4-12-5-8)14-10-13-6-9(11)15-10/h2-7H,11H2,1H3,(H,13,14)
InChIKeyHYIYOIPMHQTZDS-UHFFFAOYSA-N
MW220.30 g/mol
LogP2.29
Rot. Bonds3

About 2-N-(1-pyridin-3-ylethyl)-1,3-thiazole-2,5-diamine

2-N-(1-pyridin-3-ylethyl)-1,3-thiazole-2,5-diamine (PubChem CID 102767611) has the molecular formula C10H12N4S and a molecular weight of 220.30 g/mol. Its IUPAC name is 2-N-(1-pyridin-3-ylethyl)-1,3-thiazole-2,5-diamine.

Molecular Properties

Compound Name2-N-(1-pyridin-3-ylethyl)-1,3-thiazole-2,5-diamine
PubChem CID102767611
Molecular FormulaC10H12N4S
Molecular Weight220.30 g/mol
Exact Mass220.08
IUPAC Name2-N-(1-pyridin-3-ylethyl)-1,3-thiazole-2,5-diamine
SMILESCC(Nc1ncc(N)s1)c1cccnc1
InChIInChI=1S/C10H12N4S/c1-7(8-3-2-4-12-5-8)14-10-13-6-9(11)15-10/h2-7H,11H2,1H3,(H,13,14)
InChIKeyHYIYOIPMHQTZDS-UHFFFAOYSA-N
XLogP2.29
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.30
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-N-(1-pyridin-3-ylethyl)pyrimidine-2,5-diamine
CID 61146602
5-methyl-2-(1-pyridin-3-ylethylamino)-1,3-thiazole-4-carboxylic acid
CID 115423528
ethyl 5-methyl-2-(1-pyridin-3-ylethylamino)-1,3-thiazole-4-carboxylate
CID 116526509
5-bromo-N-(1-pyridin-3-ylethyl)pyridin-2-amine
CID 43523794
6-methyl-N-(1-pyridin-3-ylethyl)-1,3-benzothiazol-2-amine
CID 79142414
(1R)-N-methyl-1-pyridin-3-ylethanamine
CID 26248773
5-fluoro-4-N-(1-pyridin-3-ylethyl)pyrimidine-2,4-diamine
CID 80778949
5-chloro-4-N-(1-pyridin-3-ylethyl)pyrimidine-4,6-diamine
CID 114049758
5-propan-2-yl-4-N-(1-pyridin-3-ylethyl)pyrimidine-4,6-diamine
CID 80779879
1-[3-amino-5-(1-pyridin-3-ylethylamino)thiophen-2-yl]ethanone
CID 103427458
6-chloro-2-N-(1-pyridin-3-ylethyl)-1,3,5-triazine-2,4-diamine
CID 80781008
(1S)-1-phenyl-N-[(1S)-1-pyridin-3-ylethyl]ethanamine
CID 11413502

Frequently Asked Questions

What is the IUPAC name of 2-N-(1-pyridin-3-ylethyl)-1,3-thiazole-2,5-diamine?
The IUPAC name of 2-N-(1-pyridin-3-ylethyl)-1,3-thiazole-2,5-diamine (CID 102767611) is 2-N-(1-pyridin-3-ylethyl)-1,3-thiazole-2,5-diamine.
What is the SMILES notation for 2-N-(1-pyridin-3-ylethyl)-1,3-thiazole-2,5-diamine?
The canonical SMILES for 2-N-(1-pyridin-3-ylethyl)-1,3-thiazole-2,5-diamine is CC(Nc1ncc(N)s1)c1cccnc1.
What is the InChIKey of 2-N-(1-pyridin-3-ylethyl)-1,3-thiazole-2,5-diamine?
The InChIKey is HYIYOIPMHQTZDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4S/c1-7(8-3-2-4-12-5-8)14-10-13-6-9(11)15-10/h2-7H,11H2,1H3,(H,13,14).
What are the key properties of 2-N-(1-pyridin-3-ylethyl)-1,3-thiazole-2,5-diamine?
2-N-(1-pyridin-3-ylethyl)-1,3-thiazole-2,5-diamine has a molecular weight of 220.30 g/mol, XLogP of 2.29, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(1-pyridin-3-ylethyl)-1,3-thiazole-2,5-diamine is sourced from PubChem (CID 102767611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).