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

C18H26N2 — CID 61011640

IUPACN-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine
SMILESCN1C2CCC1CC(CNC1CCc3ccccc31)C2
InChIInChI=1S/C18H26N2/c1-20-15-7-8-16(20)11-13(10-15)12-19-18-9-6-14-4-2-3-5-17(14)18/h2-5,13,15-16,18-19H,6-12H2,1H3
InChIKeyKVNNOHCAFFBYFO-UHFFFAOYSA-N
MW270.42 g/mol
LogP3.14
Rot. Bonds3

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

N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine (PubChem CID 61011640) has the molecular formula C18H26N2 and a molecular weight of 270.42 g/mol. Its IUPAC name is N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound NameN-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine
PubChem CID61011640
Molecular FormulaC18H26N2
Molecular Weight270.42 g/mol
Exact Mass270.21
IUPAC NameN-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine
SMILESCN1C2CCC1CC(CNC1CCc3ccccc31)C2
InChIInChI=1S/C18H26N2/c1-20-15-7-8-16(20)11-13(10-15)12-19-18-9-6-14-4-2-3-5-17(14)18/h2-5,13,15-16,18-19H,6-12H2,1H3
InChIKeyKVNNOHCAFFBYFO-UHFFFAOYSA-N
XLogP3.14
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine with MolForge

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Related Compounds

N-(cyclopentylmethyl)-2,3-dihydro-1H-inden-1-amine
CID 43370878
N-[(1,1-dioxothiolan-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine
CID 54915639
N-(cyclopentylmethyl)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 43370921
2-(2,3-dihydro-1H-inden-1-ylamino)-1-phenylethanol
CID 43394134
tert-butyl 3-[(2,3-dihydro-1H-inden-1-ylamino)methyl]pyrrolidine-1-carboxylate
CID 104538154
1-cyclopentyl-3-(2,3-dihydro-1H-inden-1-ylamino)propan-2-ol
CID 103157324
2-iodo-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-4-amine
CID 82011358
N-(2,2,2-trifluoroethyl)-2,3-dihydro-1H-inden-1-amine
CID 24702173
N-[(4-propan-2-ylmorpholin-2-yl)methyl]-2,3-dihydro-1H-inden-1-amine
CID 64534300
5-[(2,3-dihydro-1H-inden-1-ylamino)methyl]pyrrolidin-2-one
CID 60727404
2-[[(1S)-2,3-dihydro-1H-inden-1-yl]amino]acetic acid
CID 13100819
N-[(1-methylpiperidin-4-yl)methyl]-2,3,4,5-tetrahydro-1H-2-benzazepin-5-amine
CID 103981901

Frequently Asked Questions

What is the IUPAC name of N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine (CID 61011640) is N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine is CN1C2CCC1CC(CNC1CCc3ccccc31)C2.
What is the InChIKey of N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine?
The InChIKey is KVNNOHCAFFBYFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2/c1-20-15-7-8-16(20)11-13(10-15)12-19-18-9-6-14-4-2-3-5-17(14)18/h2-5,13,15-16,18-19H,6-12H2,1H3.
What are the key properties of N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine?
N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine has a molecular weight of 270.42 g/mol, XLogP of 3.14, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 61011640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).