2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)octan-2-amine

C14H24N2S — CID 61330299

IUPAC2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)octan-2-amine
SMILESCCCCCCC(C)(N)c1nc2c(s1)CCC2
InChIInChI=1S/C14H24N2S/c1-3-4-5-6-10-14(2,15)13-16-11-8-7-9-12(11)17-13/h3-10,15H2,1-2H3
InChIKeyAUDKVGYVFKVWFC-UHFFFAOYSA-N
MW252.43 g/mol
LogP3.78
Rot. Bonds6

About 2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)octan-2-amine

2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)octan-2-amine (PubChem CID 61330299) has the molecular formula C14H24N2S and a molecular weight of 252.43 g/mol. Its IUPAC name is 2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)octan-2-amine.

Molecular Properties

Compound Name2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)octan-2-amine
PubChem CID61330299
Molecular FormulaC14H24N2S
Molecular Weight252.43 g/mol
Exact Mass252.17
IUPAC Name2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)octan-2-amine
SMILESCCCCCCC(C)(N)c1nc2c(s1)CCC2
InChIInChI=1S/C14H24N2S/c1-3-4-5-6-10-14(2,15)13-16-11-8-7-9-12(11)17-13/h3-10,15H2,1-2H3
InChIKeyAUDKVGYVFKVWFC-UHFFFAOYSA-N
XLogP3.78
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.43
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)octan-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

2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-propylheptan-2-amine
CID 80558649
2-(4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[d][1,3]thiazol-2-yl)butan-2-amine
CID 63526067
N-(2-methoxyethyl)-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)heptan-2-amine
CID 80556446
2-(4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[d][1,3]thiazol-2-yl)propan-2-amine
CID 55222989
3-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-propylhexan-3-amine
CID 114079947
1-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)hexan-1-amine
CID 61332281
2,6-dimethyl-4-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)heptan-4-amine
CID 114868544
5-methyl-N-propyl-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)hexan-2-amine
CID 63405307
3-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-2-methyl-N-propylpentan-3-amine
CID 61334992
2-propyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole
CID 130511936
2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-(2-methoxyethyl)butan-2-amine
CID 62542108
2-ethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole
CID 58541380

Frequently Asked Questions

What is the IUPAC name of 2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)octan-2-amine?
The IUPAC name of 2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)octan-2-amine (CID 61330299) is 2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)octan-2-amine.
What is the SMILES notation for 2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)octan-2-amine?
The canonical SMILES for 2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)octan-2-amine is CCCCCCC(C)(N)c1nc2c(s1)CCC2.
What is the InChIKey of 2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)octan-2-amine?
The InChIKey is AUDKVGYVFKVWFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2S/c1-3-4-5-6-10-14(2,15)13-16-11-8-7-9-12(11)17-13/h3-10,15H2,1-2H3.
What are the key properties of 2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)octan-2-amine?
2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)octan-2-amine has a molecular weight of 252.43 g/mol, XLogP of 3.78, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)octan-2-amine is sourced from PubChem (CID 61330299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).