3-(2,3-dihydroindol-1-yl)cyclobutan-1-amine

C12H16N2 — CID 80561205

IUPAC3-(2,3-dihydroindol-1-yl)cyclobutan-1-amine
SMILESNC1CC(N2CCc3ccccc32)C1
InChIInChI=1S/C12H16N2/c13-10-7-11(8-10)14-6-5-9-3-1-2-4-12(9)14/h1-4,10-11H,5-8,13H2
InChIKeyWUIMNPNPFBLZKY-UHFFFAOYSA-N
MW188.27 g/mol
LogP1.54
Rot. Bonds1

About 3-(2,3-dihydroindol-1-yl)cyclobutan-1-amine

3-(2,3-dihydroindol-1-yl)cyclobutan-1-amine (PubChem CID 80561205) has the molecular formula C12H16N2 and a molecular weight of 188.27 g/mol. Its IUPAC name is 3-(2,3-dihydroindol-1-yl)cyclobutan-1-amine.

Molecular Properties

Compound Name3-(2,3-dihydroindol-1-yl)cyclobutan-1-amine
PubChem CID80561205
Molecular FormulaC12H16N2
Molecular Weight188.27 g/mol
Exact Mass188.13
IUPAC Name3-(2,3-dihydroindol-1-yl)cyclobutan-1-amine
SMILESNC1CC(N2CCc3ccccc32)C1
InChIInChI=1S/C12H16N2/c13-10-7-11(8-10)14-6-5-9-3-1-2-4-12(9)14/h1-4,10-11H,5-8,13H2
InChIKeyWUIMNPNPFBLZKY-UHFFFAOYSA-N
XLogP1.54
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3,4-dihydro-2H-quinolin-1-yl)cyclopentan-1-amine
CID 79464524
(3R)-3-(2,3-dihydroindol-1-yl)cyclopentan-1-one
CID 102451637
3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)cyclopentan-1-amine;ethane
CID 144534685
1-pyrrolidin-3-yl-2,3-dihydroindole;dihydrochloride
CID 53407976
1-amino-4-(2,3-dihydroindol-1-yl)cyclohexane-1-carbonitrile
CID 117038171
ethane;1-(1-ethylpiperidin-4-yl)-2,3-dihydroindole;vanadium
CID 161158486
2,3,4,4a,5,6-hexahydro-1H-benzo[c]quinolizine
CID 13380222
2,3-dihydroindol-1-amine;dihydrochloride
CID 172716948
4-(2,3-dihydroindol-1-yl)-1-(dimethylamino)cyclohexane-1-carbonitrile
CID 117038204
1-[(2R)-oxan-2-yl]-2,3-dihydroindole
CID 134858745
8-(1,2,3,4-tetrahydronaphthalen-2-yl)-8-azabicyclo[3.2.1]octan-3-amine
CID 61236085
2,3-dihydroindol-1-ylsilane
CID 149251229

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dihydroindol-1-yl)cyclobutan-1-amine?
The IUPAC name of 3-(2,3-dihydroindol-1-yl)cyclobutan-1-amine (CID 80561205) is 3-(2,3-dihydroindol-1-yl)cyclobutan-1-amine.
What is the SMILES notation for 3-(2,3-dihydroindol-1-yl)cyclobutan-1-amine?
The canonical SMILES for 3-(2,3-dihydroindol-1-yl)cyclobutan-1-amine is NC1CC(N2CCc3ccccc32)C1.
What is the InChIKey of 3-(2,3-dihydroindol-1-yl)cyclobutan-1-amine?
The InChIKey is WUIMNPNPFBLZKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2/c13-10-7-11(8-10)14-6-5-9-3-1-2-4-12(9)14/h1-4,10-11H,5-8,13H2.
What are the key properties of 3-(2,3-dihydroindol-1-yl)cyclobutan-1-amine?
3-(2,3-dihydroindol-1-yl)cyclobutan-1-amine has a molecular weight of 188.27 g/mol, XLogP of 1.54, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dihydroindol-1-yl)cyclobutan-1-amine is sourced from PubChem (CID 80561205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).