N-(8-azabicyclo[3.2.1]octan-3-ylmethyl)-N-propyl-2,3-dihydro-1H-inden-2-amine

C20H30N2 — CID 20649393

IUPACN-(8-azabicyclo[3.2.1]octan-3-ylmethyl)-N-propyl-2,3-dihydro-1H-inden-2-amine
SMILESCCCN(CC1CC2CCC(C1)N2)C1Cc2ccccc2C1
InChIInChI=1S/C20H30N2/c1-2-9-22(14-15-10-18-7-8-19(11-15)21-18)20-12-16-5-3-4-6-17(16)13-20/h3-6,15,18-21H,2,7-14H2,1H3
InChIKeySCOHDPLHVXUNNB-UHFFFAOYSA-N
MW298.47 g/mol
LogP3.40
Rot. Bonds5

About N-(8-azabicyclo[3.2.1]octan-3-ylmethyl)-N-propyl-2,3-dihydro-1H-inden-2-amine

N-(8-azabicyclo[3.2.1]octan-3-ylmethyl)-N-propyl-2,3-dihydro-1H-inden-2-amine (PubChem CID 20649393) has the molecular formula C20H30N2 and a molecular weight of 298.47 g/mol. Its IUPAC name is N-(8-azabicyclo[3.2.1]octan-3-ylmethyl)-N-propyl-2,3-dihydro-1H-inden-2-amine.

Molecular Properties

Compound NameN-(8-azabicyclo[3.2.1]octan-3-ylmethyl)-N-propyl-2,3-dihydro-1H-inden-2-amine
PubChem CID20649393
Molecular FormulaC20H30N2
Molecular Weight298.47 g/mol
Exact Mass298.24
IUPAC NameN-(8-azabicyclo[3.2.1]octan-3-ylmethyl)-N-propyl-2,3-dihydro-1H-inden-2-amine
SMILESCCCN(CC1CC2CCC(C1)N2)C1Cc2ccccc2C1
InChIInChI=1S/C20H30N2/c1-2-9-22(14-15-10-18-7-8-19(11-15)21-18)20-12-16-5-3-4-6-17(16)13-20/h3-6,15,18-21H,2,7-14H2,1H3
InChIKeySCOHDPLHVXUNNB-UHFFFAOYSA-N
XLogP3.40
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.47
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(8-azabicyclo[3.2.1]octan-3-ylmethyl)-N-propyl-2,3-dihydro-1H-inden-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

Frequently Asked Questions

What is the IUPAC name of N-(8-azabicyclo[3.2.1]octan-3-ylmethyl)-N-propyl-2,3-dihydro-1H-inden-2-amine?
The IUPAC name of N-(8-azabicyclo[3.2.1]octan-3-ylmethyl)-N-propyl-2,3-dihydro-1H-inden-2-amine (CID 20649393) is N-(8-azabicyclo[3.2.1]octan-3-ylmethyl)-N-propyl-2,3-dihydro-1H-inden-2-amine.
What is the SMILES notation for N-(8-azabicyclo[3.2.1]octan-3-ylmethyl)-N-propyl-2,3-dihydro-1H-inden-2-amine?
The canonical SMILES for N-(8-azabicyclo[3.2.1]octan-3-ylmethyl)-N-propyl-2,3-dihydro-1H-inden-2-amine is CCCN(CC1CC2CCC(C1)N2)C1Cc2ccccc2C1.
What is the InChIKey of N-(8-azabicyclo[3.2.1]octan-3-ylmethyl)-N-propyl-2,3-dihydro-1H-inden-2-amine?
The InChIKey is SCOHDPLHVXUNNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N2/c1-2-9-22(14-15-10-18-7-8-19(11-15)21-18)20-12-16-5-3-4-6-17(16)13-20/h3-6,15,18-21H,2,7-14H2,1H3.
What are the key properties of N-(8-azabicyclo[3.2.1]octan-3-ylmethyl)-N-propyl-2,3-dihydro-1H-inden-2-amine?
N-(8-azabicyclo[3.2.1]octan-3-ylmethyl)-N-propyl-2,3-dihydro-1H-inden-2-amine has a molecular weight of 298.47 g/mol, XLogP of 3.40, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-azabicyclo[3.2.1]octan-3-ylmethyl)-N-propyl-2,3-dihydro-1H-inden-2-amine is sourced from PubChem (CID 20649393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).