N-methyl-2,3,4,4a,5,6-hexahydro-1H-benzo[c]quinolizin-6-amine

C14H20N2 — CID 82393610

IUPACN-methyl-2,3,4,4a,5,6-hexahydro-1H-benzo[c]quinolizin-6-amine
SMILESCNC1CC2CCCCN2c2ccccc21
InChIInChI=1S/C14H20N2/c1-15-13-10-11-6-4-5-9-16(11)14-8-3-2-7-12(13)14/h2-3,7-8,11,13,15H,4-6,9-10H2,1H3
InChIKeyLOQDLKCENUEBDX-UHFFFAOYSA-N
MW216.33 g/mol
LogP2.71
Rot. Bonds1

About N-methyl-2,3,4,4a,5,6-hexahydro-1H-benzo[c]quinolizin-6-amine

N-methyl-2,3,4,4a,5,6-hexahydro-1H-benzo[c]quinolizin-6-amine (PubChem CID 82393610) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is N-methyl-2,3,4,4a,5,6-hexahydro-1H-benzo[c]quinolizin-6-amine.

Molecular Properties

Compound NameN-methyl-2,3,4,4a,5,6-hexahydro-1H-benzo[c]quinolizin-6-amine
PubChem CID82393610
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC NameN-methyl-2,3,4,4a,5,6-hexahydro-1H-benzo[c]quinolizin-6-amine
SMILESCNC1CC2CCCCN2c2ccccc21
InChIInChI=1S/C14H20N2/c1-15-13-10-11-6-4-5-9-16(11)14-8-3-2-7-12(13)14/h2-3,7-8,11,13,15H,4-6,9-10H2,1H3
InChIKeyLOQDLKCENUEBDX-UHFFFAOYSA-N
XLogP2.71
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-methyl-2,3,4,4a,5,6-hexahydro-1H-benzo[c]quinolizin-6-amine with MolForge

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Related Compounds

1-(3,5-dimethylcyclohexyl)-N-methyl-3,4-dihydro-2H-quinolin-4-amine
CID 64734907
(4aS,6R)-6-phenyl-2,3,4,4a,5,6-hexahydro-1H-benzo[c]quinolizine
CID 164666156
2,3,4,4a,5,6-hexahydro-1H-benzo[c]quinolizine
CID 13380222
1-ethyl-N-methyl-2,3,4,5-tetrahydro-1-benzazepin-5-amine
CID 114336204
1-(1,1-dioxothiolan-3-yl)-N-ethyl-2,3,4,5-tetrahydro-1-benzazepin-5-amine
CID 114336368
N-methyl-1-propyl-2,3,4,5-tetrahydro-1-benzazepin-5-amine
CID 114336172
(11R,11aS)-N-methyl-2,3,4,6,11,11a-hexahydro-1H-benzo[b]quinolizin-11-amine
CID 12967038
N-ethyl-1-(4-ethylcyclohexyl)-3,4-dihydro-2H-quinolin-4-amine
CID 64749629
2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]indole
CID 11744913
5,6,6a,7,8,9,10,11-octahydroazepino[1,2-a]quinoxaline
CID 10488339
N-methyl-5,6,7,8,9,10-hexahydrobenzo[8]annulen-5-amine
CID 123748338
N-methyl-1-propan-2-ylsulfonyl-2,3,4,5-tetrahydro-1-benzazepin-5-amine
CID 114335951

Frequently Asked Questions

What is the IUPAC name of N-methyl-2,3,4,4a,5,6-hexahydro-1H-benzo[c]quinolizin-6-amine?
The IUPAC name of N-methyl-2,3,4,4a,5,6-hexahydro-1H-benzo[c]quinolizin-6-amine (CID 82393610) is N-methyl-2,3,4,4a,5,6-hexahydro-1H-benzo[c]quinolizin-6-amine.
What is the SMILES notation for N-methyl-2,3,4,4a,5,6-hexahydro-1H-benzo[c]quinolizin-6-amine?
The canonical SMILES for N-methyl-2,3,4,4a,5,6-hexahydro-1H-benzo[c]quinolizin-6-amine is CNC1CC2CCCCN2c2ccccc21.
What is the InChIKey of N-methyl-2,3,4,4a,5,6-hexahydro-1H-benzo[c]quinolizin-6-amine?
The InChIKey is LOQDLKCENUEBDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2/c1-15-13-10-11-6-4-5-9-16(11)14-8-3-2-7-12(13)14/h2-3,7-8,11,13,15H,4-6,9-10H2,1H3.
What are the key properties of N-methyl-2,3,4,4a,5,6-hexahydro-1H-benzo[c]quinolizin-6-amine?
N-methyl-2,3,4,4a,5,6-hexahydro-1H-benzo[c]quinolizin-6-amine has a molecular weight of 216.33 g/mol, XLogP of 2.71, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2,3,4,4a,5,6-hexahydro-1H-benzo[c]quinolizin-6-amine is sourced from PubChem (CID 82393610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).