N-[1-(2-chlorophenyl)ethyl]-1,2,4-thiadiazol-5-amine

C10H10ClN3S — CID 65277052

IUPACN-[1-(2-chlorophenyl)ethyl]-1,2,4-thiadiazol-5-amine
SMILESCC(Nc1ncns1)c1ccccc1Cl
InChIInChI=1S/C10H10ClN3S/c1-7(14-10-12-6-13-15-10)8-4-2-3-5-9(8)11/h2-7H,1H3,(H,12,13,14)
InChIKeyQWHZTWNTCMEKGL-UHFFFAOYSA-N
MW239.73 g/mol
LogP3.36
Rot. Bonds3

About N-[1-(2-chlorophenyl)ethyl]-1,2,4-thiadiazol-5-amine

N-[1-(2-chlorophenyl)ethyl]-1,2,4-thiadiazol-5-amine (PubChem CID 65277052) has the molecular formula C10H10ClN3S and a molecular weight of 239.73 g/mol. Its IUPAC name is N-[1-(2-chlorophenyl)ethyl]-1,2,4-thiadiazol-5-amine.

Molecular Properties

Compound NameN-[1-(2-chlorophenyl)ethyl]-1,2,4-thiadiazol-5-amine
PubChem CID65277052
Molecular FormulaC10H10ClN3S
Molecular Weight239.73 g/mol
Exact Mass239.03
IUPAC NameN-[1-(2-chlorophenyl)ethyl]-1,2,4-thiadiazol-5-amine
SMILESCC(Nc1ncns1)c1ccccc1Cl
InChIInChI=1S/C10H10ClN3S/c1-7(14-10-12-6-13-15-10)8-4-2-3-5-9(8)11/h2-7H,1H3,(H,12,13,14)
InChIKeyQWHZTWNTCMEKGL-UHFFFAOYSA-N
XLogP3.36
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.73
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[1-(2-chlorophenyl)ethyl]-1,2,4-thiadiazol-5-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-[(1R)-1-(2-chlorophenyl)ethyl]pyridin-4-amine
CID 141011393
N-[1-(4-fluorophenyl)ethyl]-1,2,4-thiadiazol-5-amine
CID 65276833
6-bromo-N-[1-(2-chlorophenyl)ethyl]pyridin-3-amine
CID 113228015
(1S)-1-(2-chlorophenyl)-N-methylethanamine
CID 30073865
2-[1-(2-chlorophenyl)ethylamino]-4-methyl-1,3-thiazole-5-carboxylic acid
CID 80569922
N-[1-(2-chlorophenyl)ethyl]-5-fluoro-1,3-benzothiazol-2-amine
CID 63544982
N-[1-(2-chlorophenyl)ethyl]-6-methoxypyridin-3-amine
CID 43189825
3-chloro-N-[1-(2-chlorophenyl)ethyl]pyridin-4-amine
CID 79769972
6-chloro-N-[1-(2-chlorophenyl)ethyl]-2-methylpyrimidin-4-amine
CID 55080193
N-[1-(2-chlorophenyl)ethyl]-1,3-benzothiazol-5-amine
CID 154860585
5-[1-(2-chlorophenyl)ethylamino]pyridine-2-carbonitrile
CID 79840053
N-[1-(2-chlorophenyl)ethyl]-2-methoxypyridin-3-amine
CID 43721825

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-chlorophenyl)ethyl]-1,2,4-thiadiazol-5-amine?
The IUPAC name of N-[1-(2-chlorophenyl)ethyl]-1,2,4-thiadiazol-5-amine (CID 65277052) is N-[1-(2-chlorophenyl)ethyl]-1,2,4-thiadiazol-5-amine.
What is the SMILES notation for N-[1-(2-chlorophenyl)ethyl]-1,2,4-thiadiazol-5-amine?
The canonical SMILES for N-[1-(2-chlorophenyl)ethyl]-1,2,4-thiadiazol-5-amine is CC(Nc1ncns1)c1ccccc1Cl.
What is the InChIKey of N-[1-(2-chlorophenyl)ethyl]-1,2,4-thiadiazol-5-amine?
The InChIKey is QWHZTWNTCMEKGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClN3S/c1-7(14-10-12-6-13-15-10)8-4-2-3-5-9(8)11/h2-7H,1H3,(H,12,13,14).
What are the key properties of N-[1-(2-chlorophenyl)ethyl]-1,2,4-thiadiazol-5-amine?
N-[1-(2-chlorophenyl)ethyl]-1,2,4-thiadiazol-5-amine has a molecular weight of 239.73 g/mol, XLogP of 3.36, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-chlorophenyl)ethyl]-1,2,4-thiadiazol-5-amine is sourced from PubChem (CID 65277052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).