N-[(4-cyclopentylthiadiazol-5-yl)methyl]ethanamine

C10H17N3S — CID 65209282

IUPACN-[(4-cyclopentylthiadiazol-5-yl)methyl]ethanamine
SMILESCCNCc1snnc1C1CCCC1
InChIInChI=1S/C10H17N3S/c1-2-11-7-9-10(12-13-14-9)8-5-3-4-6-8/h8,11H,2-7H2,1H3
InChIKeyYEGITNVAEGNOBO-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.31
Rot. Bonds4

About N-[(4-cyclopentylthiadiazol-5-yl)methyl]ethanamine

N-[(4-cyclopentylthiadiazol-5-yl)methyl]ethanamine (PubChem CID 65209282) has the molecular formula C10H17N3S and a molecular weight of 211.33 g/mol. Its IUPAC name is N-[(4-cyclopentylthiadiazol-5-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(4-cyclopentylthiadiazol-5-yl)methyl]ethanamine
PubChem CID65209282
Molecular FormulaC10H17N3S
Molecular Weight211.33 g/mol
Exact Mass211.11
IUPAC NameN-[(4-cyclopentylthiadiazol-5-yl)methyl]ethanamine
SMILESCCNCc1snnc1C1CCCC1
InChIInChI=1S/C10H17N3S/c1-2-11-7-9-10(12-13-14-9)8-5-3-4-6-8/h8,11H,2-7H2,1H3
InChIKeyYEGITNVAEGNOBO-UHFFFAOYSA-N
XLogP2.31
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(4-cyclopentylthiadiazol-5-yl)methyl]ethanamine 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-ethyl-4,4,4-trifluoro-1-(4-propylthiadiazol-5-yl)butan-1-amine
CID 105156295
1-(4-tert-butylthiadiazol-5-yl)-N-ethyl-4,4,4-trifluorobutan-1-amine
CID 105156329
4,4,4-trifluoro-1-(4-methylthiadiazol-5-yl)-N-propylbutan-1-amine
CID 105156395
1-(4-tert-butylthiadiazol-5-yl)-4,4,4-trifluoro-N-propylbutan-1-amine
CID 105156399
4,4,4-trifluoro-N-propyl-1-(4-propylthiadiazol-5-yl)butan-1-amine
CID 105156400
4,4,4-trifluoro-1-(4-propan-2-ylthiadiazol-5-yl)-N-propylbutan-1-amine
CID 105156401
4,4,4-trifluoro-N-methyl-1-(4-propan-2-ylthiadiazol-5-yl)butan-1-amine
CID 105156416
1-(4-tert-butylthiadiazol-5-yl)-4,4,4-trifluoro-N-methylbutan-1-amine
CID 105156459
N-ethyl-1-(4-ethylthiadiazol-5-yl)-4,4,4-trifluorobutan-1-amine
CID 105156470
1-(4-ethylthiadiazol-5-yl)-4,4,4-trifluoro-N-propylbutan-1-amine
CID 105156519
5,5,5-trifluoro-N-methyl-1-(4-propylthiadiazol-5-yl)pentan-1-amine
CID 105174246
N-ethyl-5,5,5-trifluoro-1-(4-propylthiadiazol-5-yl)pentan-1-amine
CID 105174282

Frequently Asked Questions

What is the IUPAC name of N-[(4-cyclopentylthiadiazol-5-yl)methyl]ethanamine?
The IUPAC name of N-[(4-cyclopentylthiadiazol-5-yl)methyl]ethanamine (CID 65209282) is N-[(4-cyclopentylthiadiazol-5-yl)methyl]ethanamine.
What is the SMILES notation for N-[(4-cyclopentylthiadiazol-5-yl)methyl]ethanamine?
The canonical SMILES for N-[(4-cyclopentylthiadiazol-5-yl)methyl]ethanamine is CCNCc1snnc1C1CCCC1.
What is the InChIKey of N-[(4-cyclopentylthiadiazol-5-yl)methyl]ethanamine?
The InChIKey is YEGITNVAEGNOBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3S/c1-2-11-7-9-10(12-13-14-9)8-5-3-4-6-8/h8,11H,2-7H2,1H3.
What are the key properties of N-[(4-cyclopentylthiadiazol-5-yl)methyl]ethanamine?
N-[(4-cyclopentylthiadiazol-5-yl)methyl]ethanamine has a molecular weight of 211.33 g/mol, XLogP of 2.31, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-cyclopentylthiadiazol-5-yl)methyl]ethanamine is sourced from PubChem (CID 65209282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).