N-(3-indol-1-ylpropyl)cyclooctanamine

C19H28N2 — CID 29267524

IUPACN-(3-indol-1-ylpropyl)cyclooctanamine
SMILESc1ccc2c(c1)ccn2CCCNC1CCCCCCC1
InChIInChI=1S/C19H28N2/c1-2-4-10-18(11-5-3-1)20-14-8-15-21-16-13-17-9-6-7-12-19(17)21/h6-7,9,12-13,16,18,20H,1-5,8,10-11,14-15H2
InChIKeyWPLQLENIHIHZMC-UHFFFAOYSA-N
MW284.45 g/mol
LogP4.73
Rot. Bonds5

About N-(3-indol-1-ylpropyl)cyclooctanamine

N-(3-indol-1-ylpropyl)cyclooctanamine (PubChem CID 29267524) has the molecular formula C19H28N2 and a molecular weight of 284.45 g/mol. Its IUPAC name is N-(3-indol-1-ylpropyl)cyclooctanamine.

Molecular Properties

Compound NameN-(3-indol-1-ylpropyl)cyclooctanamine
PubChem CID29267524
Molecular FormulaC19H28N2
Molecular Weight284.45 g/mol
Exact Mass284.23
IUPAC NameN-(3-indol-1-ylpropyl)cyclooctanamine
SMILESc1ccc2c(c1)ccn2CCCNC1CCCCCCC1
InChIInChI=1S/C19H28N2/c1-2-4-10-18(11-5-3-1)20-14-8-15-21-16-13-17-9-6-7-12-19(17)21/h6-7,9,12-13,16,18,20H,1-5,8,10-11,14-15H2
InChIKeyWPLQLENIHIHZMC-UHFFFAOYSA-N
XLogP4.73
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.45
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(3-indol-1-ylpropyl)-1-methylpiperidin-4-amine
CID 28716039
N-(3-indol-1-ylpropyl)-3-methylcyclohexan-1-amine
CID 43078302
N-(2-indol-1-ylethyl)cyclopropanamine
CID 62562475
N-(3-indol-1-ylpropyl)-1,1-dioxothian-3-amine
CID 63910668
N-[3-(5-chloroindol-1-yl)propyl]cyclohexanamine
CID 63879211
N-(3-indol-1-ylpropyl)-1-(pyridin-2-ylmethyl)piperidin-4-amine
CID 75382409
1-[3-(cyclohexylamino)propyl]indole-5-carbonitrile
CID 107920048
N-(3-indol-1-ylpropyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
CID 82823981
N-[3-[6-(1,2,4-triazol-4-yl)indol-1-yl]propyl]cyclohexanamine
CID 18796590
4-(cyclohexylcarbamoylamino)-N-(3-indol-1-ylpropyl)butanamide
CID 16614939
formic acid;5-(3-indol-1-ylpropylamino)azepan-2-one
CID 154913019
N-(3-indol-1-ylpropyl)-2-methylthiolan-3-amine
CID 102671461

Frequently Asked Questions

What is the IUPAC name of N-(3-indol-1-ylpropyl)cyclooctanamine?
The IUPAC name of N-(3-indol-1-ylpropyl)cyclooctanamine (CID 29267524) is N-(3-indol-1-ylpropyl)cyclooctanamine.
What is the SMILES notation for N-(3-indol-1-ylpropyl)cyclooctanamine?
The canonical SMILES for N-(3-indol-1-ylpropyl)cyclooctanamine is c1ccc2c(c1)ccn2CCCNC1CCCCCCC1.
What is the InChIKey of N-(3-indol-1-ylpropyl)cyclooctanamine?
The InChIKey is WPLQLENIHIHZMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2/c1-2-4-10-18(11-5-3-1)20-14-8-15-21-16-13-17-9-6-7-12-19(17)21/h6-7,9,12-13,16,18,20H,1-5,8,10-11,14-15H2.
What are the key properties of N-(3-indol-1-ylpropyl)cyclooctanamine?
N-(3-indol-1-ylpropyl)cyclooctanamine has a molecular weight of 284.45 g/mol, XLogP of 4.73, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-indol-1-ylpropyl)cyclooctanamine is sourced from PubChem (CID 29267524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).