1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinolin-1-amine

C12H16N2 — CID 105443269

IUPAC1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinolin-1-amine
SMILESNC1CCC2CCc3ccccc3N12
InChIInChI=1S/C12H16N2/c13-12-8-7-10-6-5-9-3-1-2-4-11(9)14(10)12/h1-4,10,12H,5-8,13H2
InChIKeyBIIQUZADSDOXAM-UHFFFAOYSA-N
MW188.27 g/mol
LogP1.89
Rot. Bonds

About 1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinolin-1-amine

1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinolin-1-amine (PubChem CID 105443269) has the molecular formula C12H16N2 and a molecular weight of 188.27 g/mol. Its IUPAC name is 1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinolin-1-amine.

Molecular Properties

Compound Name1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinolin-1-amine
PubChem CID105443269
Molecular FormulaC12H16N2
Molecular Weight188.27 g/mol
Exact Mass188.13
IUPAC Name1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinolin-1-amine
SMILESNC1CCC2CCc3ccccc3N12
InChIInChI=1S/C12H16N2/c13-12-8-7-10-6-5-9-3-1-2-4-11(9)14(10)12/h1-4,10,12H,5-8,13H2
InChIKeyBIIQUZADSDOXAM-UHFFFAOYSA-N
XLogP1.89
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

7-methoxy-1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinolin-1-amine
CID 105472893
1,13-diazatetracyclo[8.7.0.02,7.013,17]heptadeca-2,4,6-trien-14-one
CID 12631875
1-amino-2,3,4,4a,5,6-hexahydro-1H-benzo[c]quinolizin-8-ol
CID 105472873
8-fluoro-2,3,4,4a,5,6-hexahydro-1H-benzo[c]quinolizin-1-amine
CID 105476015
2,3,4,4a,5,6-hexahydro-1H-benzo[c]quinolizine
CID 13380222
10-chloro-2,3,4,4a,5,6-hexahydro-1H-benzo[c]quinolizin-1-amine
CID 105498620
3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)cyclopentan-1-amine;ethane
CID 144534685
3-(3,4-dihydro-2H-quinolin-1-yl)cyclopentan-1-amine
CID 79464524
2-methyl-3,4-dihydro-2H-quinolin-1-amine
CID 10103459
3-(2-methyl-2,3-dihydroindol-1-yl)cyclopentan-1-amine
CID 79464627
1-butyl-3,4-dihydro-2H-quinolin-2-amine
CID 146573468
8-(1,2,3,4-tetrahydronaphthalen-2-yl)-8-azabicyclo[3.2.1]octan-3-amine
CID 61236085

Frequently Asked Questions

What is the IUPAC name of 1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinolin-1-amine?
The IUPAC name of 1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinolin-1-amine (CID 105443269) is 1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinolin-1-amine.
What is the SMILES notation for 1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinolin-1-amine?
The canonical SMILES for 1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinolin-1-amine is NC1CCC2CCc3ccccc3N12.
What is the InChIKey of 1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinolin-1-amine?
The InChIKey is BIIQUZADSDOXAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2/c13-12-8-7-10-6-5-9-3-1-2-4-11(9)14(10)12/h1-4,10,12H,5-8,13H2.
What are the key properties of 1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinolin-1-amine?
1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinolin-1-amine has a molecular weight of 188.27 g/mol, XLogP of 1.89, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinolin-1-amine is sourced from PubChem (CID 105443269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).