5-propyl-N-(1,2-thiazol-4-ylmethyl)-1,3-thiazol-2-amine

C10H13N3S2 — CID 136574616

IUPAC5-propyl-N-(1,2-thiazol-4-ylmethyl)-1,3-thiazol-2-amine
SMILESCCCc1cnc(NCc2cnsc2)s1
InChIInChI=1S/C10H13N3S2/c1-2-3-9-6-12-10(15-9)11-4-8-5-13-14-7-8/h5-7H,2-4H2,1H3,(H,11,12)
InChIKeyASJOTBDTBSZNII-UHFFFAOYSA-N
MW239.37 g/mol
LogP3.16
Rot. Bonds5

About 5-propyl-N-(1,2-thiazol-4-ylmethyl)-1,3-thiazol-2-amine

5-propyl-N-(1,2-thiazol-4-ylmethyl)-1,3-thiazol-2-amine (PubChem CID 136574616) has the molecular formula C10H13N3S2 and a molecular weight of 239.37 g/mol. Its IUPAC name is 5-propyl-N-(1,2-thiazol-4-ylmethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-propyl-N-(1,2-thiazol-4-ylmethyl)-1,3-thiazol-2-amine
PubChem CID136574616
Molecular FormulaC10H13N3S2
Molecular Weight239.37 g/mol
Exact Mass239.06
IUPAC Name5-propyl-N-(1,2-thiazol-4-ylmethyl)-1,3-thiazol-2-amine
SMILESCCCc1cnc(NCc2cnsc2)s1
InChIInChI=1S/C10H13N3S2/c1-2-3-9-6-12-10(15-9)11-4-8-5-13-14-7-8/h5-7H,2-4H2,1H3,(H,11,12)
InChIKeyASJOTBDTBSZNII-UHFFFAOYSA-N
XLogP3.16
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.37
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-propyl-N-(1,2-thiazol-4-ylmethyl)-1,3-thiazol-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-propyl-N-(pyridin-4-ylmethyl)-1,3-thiazol-2-amine
CID 104599847
N-[(2-methyl-1,3-thiazol-5-yl)methyl]-5-propyl-1,3-thiazol-2-amine
CID 104599843
N-[(1-ethylpyrazol-4-yl)methyl]-5-propyl-1,3-thiazol-2-amine
CID 75505668
5-propyl-N-(thiophen-2-ylmethyl)-1,3-thiazol-2-amine
CID 104599839
N-(imidazo[1,2-a]pyrazin-3-ylmethyl)-5-propyl-1,3-thiazol-2-amine
CID 86790671
N-methyl-5-[2-[2-(propylamino)-1,3-thiazol-5-yl]ethyl]-1,3-thiazol-2-amine
CID 79774348
5-ethyl-N-propyl-1,3-thiazol-2-amine
CID 62943674
5-ethyl-N-(pyridin-3-ylmethyl)-1,3-thiazol-2-amine
CID 104599802
5-ethyl-N-[(1-methylpyrrol-3-yl)methyl]-1,3-thiazol-2-amine
CID 104599771
2,5-dipropyl-1,3-thiazole
CID 588151
2-chloro-5-propyl-1,3-thiazole
CID 56625607
N-[(4-bromothiophen-2-yl)methyl]-5-ethyl-1,3-thiazol-2-amine
CID 104599797

Frequently Asked Questions

What is the IUPAC name of 5-propyl-N-(1,2-thiazol-4-ylmethyl)-1,3-thiazol-2-amine?
The IUPAC name of 5-propyl-N-(1,2-thiazol-4-ylmethyl)-1,3-thiazol-2-amine (CID 136574616) is 5-propyl-N-(1,2-thiazol-4-ylmethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 5-propyl-N-(1,2-thiazol-4-ylmethyl)-1,3-thiazol-2-amine?
The canonical SMILES for 5-propyl-N-(1,2-thiazol-4-ylmethyl)-1,3-thiazol-2-amine is CCCc1cnc(NCc2cnsc2)s1.
What is the InChIKey of 5-propyl-N-(1,2-thiazol-4-ylmethyl)-1,3-thiazol-2-amine?
The InChIKey is ASJOTBDTBSZNII-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3S2/c1-2-3-9-6-12-10(15-9)11-4-8-5-13-14-7-8/h5-7H,2-4H2,1H3,(H,11,12).
What are the key properties of 5-propyl-N-(1,2-thiazol-4-ylmethyl)-1,3-thiazol-2-amine?
5-propyl-N-(1,2-thiazol-4-ylmethyl)-1,3-thiazol-2-amine has a molecular weight of 239.37 g/mol, XLogP of 3.16, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propyl-N-(1,2-thiazol-4-ylmethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 136574616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).