N-(2-methyl-1-thiophen-2-ylpropyl)cyclooctanamine

C16H27NS — CID 43225879

IUPACN-(2-methyl-1-thiophen-2-ylpropyl)cyclooctanamine
SMILESCC(C)C(NC1CCCCCCC1)c1cccs1
InChIInChI=1S/C16H27NS/c1-13(2)16(15-11-8-12-18-15)17-14-9-6-4-3-5-7-10-14/h8,11-14,16-17H,3-7,9-10H2,1-2H3
InChIKeyPGQDRQKWDFRQBP-UHFFFAOYSA-N
MW265.47 g/mol
LogP5.15
Rot. Bonds4

About N-(2-methyl-1-thiophen-2-ylpropyl)cyclooctanamine

N-(2-methyl-1-thiophen-2-ylpropyl)cyclooctanamine (PubChem CID 43225879) has the molecular formula C16H27NS and a molecular weight of 265.47 g/mol. Its IUPAC name is N-(2-methyl-1-thiophen-2-ylpropyl)cyclooctanamine.

Molecular Properties

Compound NameN-(2-methyl-1-thiophen-2-ylpropyl)cyclooctanamine
PubChem CID43225879
Molecular FormulaC16H27NS
Molecular Weight265.47 g/mol
Exact Mass265.19
IUPAC NameN-(2-methyl-1-thiophen-2-ylpropyl)cyclooctanamine
SMILESCC(C)C(NC1CCCCCCC1)c1cccs1
InChIInChI=1S/C16H27NS/c1-13(2)16(15-11-8-12-18-15)17-14-9-6-4-3-5-7-10-14/h8,11-14,16-17H,3-7,9-10H2,1-2H3
InChIKeyPGQDRQKWDFRQBP-UHFFFAOYSA-N
XLogP5.15
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500265.47
LogP ≤ 55.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(2-methyl-1-thiophen-2-ylpropyl)cyclooctanamine 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-(1-thiophen-2-ylethyl)cyclohexanamine
CID 25219735
3-cyclopropyl-N-(2-methyl-1-thiophen-2-ylpropyl)cyclohexan-1-amine
CID 64594870
2-[(2-methyl-1-thiophen-2-ylpropyl)amino]cycloheptan-1-ol
CID 54963529
2-(cycloheptylamino)-1-thiophen-2-ylpropan-1-ol
CID 82314428
N-(2-methyl-1-thiophen-2-ylpropyl)-4-propylcyclohexan-1-amine
CID 43225917
N-(dithiophen-2-ylmethyl)cyclopentanamine
CID 43756506
2-(cyclopentylamino)-3-methyl-1-thiophen-2-ylbutan-1-ol
CID 82314559
1-methylsulfonyl-N-(2-methyl-1-thiophen-2-ylpropyl)piperidin-4-amine
CID 43778771
N-(cyclohexylmethyl)-2-methyl-1-thiophen-2-ylpropan-1-amine
CID 43225929
2-methoxy-N-(2-methyl-1-thiophen-2-ylpropyl)cyclohexan-1-amine
CID 43786628
1-ethylsulfonyl-N-(2-methyl-1-thiophen-2-ylpropyl)piperidin-4-amine
CID 43771737
N-(2-methyl-1-thiophen-2-ylpropyl)-5-oxaspiro[3.5]nonan-8-amine
CID 79895882

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-1-thiophen-2-ylpropyl)cyclooctanamine?
The IUPAC name of N-(2-methyl-1-thiophen-2-ylpropyl)cyclooctanamine (CID 43225879) is N-(2-methyl-1-thiophen-2-ylpropyl)cyclooctanamine.
What is the SMILES notation for N-(2-methyl-1-thiophen-2-ylpropyl)cyclooctanamine?
The canonical SMILES for N-(2-methyl-1-thiophen-2-ylpropyl)cyclooctanamine is CC(C)C(NC1CCCCCCC1)c1cccs1.
What is the InChIKey of N-(2-methyl-1-thiophen-2-ylpropyl)cyclooctanamine?
The InChIKey is PGQDRQKWDFRQBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NS/c1-13(2)16(15-11-8-12-18-15)17-14-9-6-4-3-5-7-10-14/h8,11-14,16-17H,3-7,9-10H2,1-2H3.
What are the key properties of N-(2-methyl-1-thiophen-2-ylpropyl)cyclooctanamine?
N-(2-methyl-1-thiophen-2-ylpropyl)cyclooctanamine has a molecular weight of 265.47 g/mol, XLogP of 5.15, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-1-thiophen-2-ylpropyl)cyclooctanamine is sourced from PubChem (CID 43225879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).