N-(1-phenylethyl)-1,3-thiazol-4-amine

C11H12N2S — CID 57022691

IUPACN-(1-phenylethyl)-1,3-thiazol-4-amine
SMILESCC(Nc1cscn1)c1ccccc1
InChIInChI=1S/C11H12N2S/c1-9(10-5-3-2-4-6-10)13-11-7-14-8-12-11/h2-9,13H,1H3
InChIKeyNKIDMPQNJXZTKL-UHFFFAOYSA-N
MW204.30 g/mol
LogP3.32
Rot. Bonds3

About N-(1-phenylethyl)-1,3-thiazol-4-amine

N-(1-phenylethyl)-1,3-thiazol-4-amine (PubChem CID 57022691) has the molecular formula C11H12N2S and a molecular weight of 204.30 g/mol. Its IUPAC name is N-(1-phenylethyl)-1,3-thiazol-4-amine.

Molecular Properties

Compound NameN-(1-phenylethyl)-1,3-thiazol-4-amine
PubChem CID57022691
Molecular FormulaC11H12N2S
Molecular Weight204.30 g/mol
Exact Mass204.07
IUPAC NameN-(1-phenylethyl)-1,3-thiazol-4-amine
SMILESCC(Nc1cscn1)c1ccccc1
InChIInChI=1S/C11H12N2S/c1-9(10-5-3-2-4-6-10)13-11-7-14-8-12-11/h2-9,13H,1H3
InChIKeyNKIDMPQNJXZTKL-UHFFFAOYSA-N
XLogP3.32
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.30
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(1-phenylethyl)-1,3-thiazol-4-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

N-benzhydryl-1-(1,3-thiazol-4-yl)ethanamine
CID 115878793
5-chloro-N-[(1S)-1-phenylethyl]pyrazin-2-amine
CID 142671286
3-[[(1S)-1-phenylethyl]amino]-1H-pyridazin-6-one
CID 121205925
5-methyl-2-N-(1-phenylethyl)pyridine-2,4-diamine
CID 83265107
4,6-difluoro-N-(1-phenylethyl)-1,3,5-triazin-2-amine
CID 19897292
2-N-phenyl-4-N-(1-phenylethyl)pyrimidine-2,4-diamine
CID 112890568
5-nitro-N-(1-phenylethyl)pyridin-2-amine
CID 571172
6-N-cyclopropyl-4-N-(1-phenylethyl)pyrimidine-4,6-diamine
CID 112854699
2-N-(1-phenylethyl)pyrazine-2,6-diamine
CID 78988844
4-N-(1-phenylethyl)pyrimidine-2,4,6-triamine
CID 80769538
6-N-methyl-4-N-(1-phenylethyl)-2-propan-2-ylpyrimidine-4,6-diamine
CID 80956022
(1E)-2-methyl-N-[(1S)-1-phenylethyl]cycloocten-1-amine
CID 10705411

Frequently Asked Questions

What is the IUPAC name of N-(1-phenylethyl)-1,3-thiazol-4-amine?
The IUPAC name of N-(1-phenylethyl)-1,3-thiazol-4-amine (CID 57022691) is N-(1-phenylethyl)-1,3-thiazol-4-amine.
What is the SMILES notation for N-(1-phenylethyl)-1,3-thiazol-4-amine?
The canonical SMILES for N-(1-phenylethyl)-1,3-thiazol-4-amine is CC(Nc1cscn1)c1ccccc1.
What is the InChIKey of N-(1-phenylethyl)-1,3-thiazol-4-amine?
The InChIKey is NKIDMPQNJXZTKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2S/c1-9(10-5-3-2-4-6-10)13-11-7-14-8-12-11/h2-9,13H,1H3.
What are the key properties of N-(1-phenylethyl)-1,3-thiazol-4-amine?
N-(1-phenylethyl)-1,3-thiazol-4-amine has a molecular weight of 204.30 g/mol, XLogP of 3.32, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-phenylethyl)-1,3-thiazol-4-amine is sourced from PubChem (CID 57022691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).