1-(4-chlorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine

C10H10ClN3S — CID 105076130

IUPAC1-(4-chlorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine
SMILESCNC(c1ccc(Cl)cc1)c1csnn1
InChIInChI=1S/C10H10ClN3S/c1-12-10(9-6-15-14-13-9)7-2-4-8(11)5-3-7/h2-6,10,12H,1H3
InChIKeyIOHHIOJFHXTTPN-UHFFFAOYSA-N
MW239.73 g/mol
LogP2.50
Rot. Bonds3

About 1-(4-chlorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine

1-(4-chlorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine (PubChem CID 105076130) has the molecular formula C10H10ClN3S and a molecular weight of 239.73 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine.

Molecular Properties

Compound Name1-(4-chlorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine
PubChem CID105076130
Molecular FormulaC10H10ClN3S
Molecular Weight239.73 g/mol
Exact Mass239.03
IUPAC Name1-(4-chlorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine
SMILESCNC(c1ccc(Cl)cc1)c1csnn1
InChIInChI=1S/C10H10ClN3S/c1-12-10(9-6-15-14-13-9)7-2-4-8(11)5-3-7/h2-6,10,12H,1H3
InChIKeyIOHHIOJFHXTTPN-UHFFFAOYSA-N
XLogP2.50
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 ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(4-chlorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine 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

1-(4-chloro-3-methoxyphenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine
CID 105164456
N-methyl-1-(thiadiazol-4-yl)-1-thiophen-3-ylmethanamine
CID 105153904
1-(2,6-difluorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine
CID 105149290
1-(4-chlorophenyl)-N-methyl-1-(4-methylthiadiazol-5-yl)methanamine
CID 105076322
2-(2,4-dichlorophenyl)-N-methyl-1-(thiadiazol-4-yl)ethanamine
CID 105132366
1-(4-chlorophenyl)-N-methyl-1-(4-propan-2-ylphenyl)methanamine
CID 43481401
1-(5-bromothiophen-3-yl)-1-(4-chlorophenyl)-N-methylmethanamine
CID 105076520
1-(3-fluoro-4-pyridinyl)-N-methyl-1-(thiadiazol-4-yl)methanamine
CID 105181850
1-(4-chlorophenyl)-1-(5-fluoro-2-pyridinyl)-N-methylmethanamine
CID 79712635
(2,5-dichlorophenyl)-(thiadiazol-4-yl)methanol
CID 105093417
1-(4-chlorophenyl)-1-(4-iodophenyl)-N-methylmethanamine
CID 43481387
N-[(4-fluorophenyl)-(thiadiazol-4-yl)methyl]propan-1-amine
CID 105087955

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine?
The IUPAC name of 1-(4-chlorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine (CID 105076130) is 1-(4-chlorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine.
What is the SMILES notation for 1-(4-chlorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine?
The canonical SMILES for 1-(4-chlorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine is CNC(c1ccc(Cl)cc1)c1csnn1.
What is the InChIKey of 1-(4-chlorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine?
The InChIKey is IOHHIOJFHXTTPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClN3S/c1-12-10(9-6-15-14-13-9)7-2-4-8(11)5-3-7/h2-6,10,12H,1H3.
What are the key properties of 1-(4-chlorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine?
1-(4-chlorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine has a molecular weight of 239.73 g/mol, XLogP of 2.50, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-N-methyl-1-(thiadiazol-4-yl)methanamine is sourced from PubChem (CID 105076130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).