N-cyclohexyl-N-methyl-5,5a,6,7,8,9,9a,10-octahydrobenzo[g]quinolin-2-amine

C20H30N2 — CID 141121657

IUPACN-cyclohexyl-N-methyl-5,5a,6,7,8,9,9a,10-octahydrobenzo[g]quinolin-2-amine
SMILESCN(c1ccc2c(n1)CC1CCCCC1C2)C1CCCCC1
InChIInChI=1S/C20H30N2/c1-22(18-9-3-2-4-10-18)20-12-11-17-13-15-7-5-6-8-16(15)14-19(17)21-20/h11-12,15-16,18H,2-10,13-14H2,1H3
InChIKeyLCPQSGVGNYTEMV-UHFFFAOYSA-N
MW298.47 g/mol
LogP4.76
Rot. Bonds2

About N-cyclohexyl-N-methyl-5,5a,6,7,8,9,9a,10-octahydrobenzo[g]quinolin-2-amine

N-cyclohexyl-N-methyl-5,5a,6,7,8,9,9a,10-octahydrobenzo[g]quinolin-2-amine (PubChem CID 141121657) has the molecular formula C20H30N2 and a molecular weight of 298.47 g/mol. Its IUPAC name is N-cyclohexyl-N-methyl-5,5a,6,7,8,9,9a,10-octahydrobenzo[g]quinolin-2-amine.

Molecular Properties

Compound NameN-cyclohexyl-N-methyl-5,5a,6,7,8,9,9a,10-octahydrobenzo[g]quinolin-2-amine
PubChem CID141121657
Molecular FormulaC20H30N2
Molecular Weight298.47 g/mol
Exact Mass298.24
IUPAC NameN-cyclohexyl-N-methyl-5,5a,6,7,8,9,9a,10-octahydrobenzo[g]quinolin-2-amine
SMILESCN(c1ccc2c(n1)CC1CCCCC1C2)C1CCCCC1
InChIInChI=1S/C20H30N2/c1-22(18-9-3-2-4-10-18)20-12-11-17-13-15-7-5-6-8-16(15)14-19(17)21-20/h11-12,15-16,18H,2-10,13-14H2,1H3
InChIKeyLCPQSGVGNYTEMV-UHFFFAOYSA-N
XLogP4.76
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.47
LogP ≤ 54.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-methyl-5,5a,6,7,8,9,9a,10-octahydrobenzo[g]quinolin-2-amine?
The IUPAC name of N-cyclohexyl-N-methyl-5,5a,6,7,8,9,9a,10-octahydrobenzo[g]quinolin-2-amine (CID 141121657) is N-cyclohexyl-N-methyl-5,5a,6,7,8,9,9a,10-octahydrobenzo[g]quinolin-2-amine.
What is the SMILES notation for N-cyclohexyl-N-methyl-5,5a,6,7,8,9,9a,10-octahydrobenzo[g]quinolin-2-amine?
The canonical SMILES for N-cyclohexyl-N-methyl-5,5a,6,7,8,9,9a,10-octahydrobenzo[g]quinolin-2-amine is CN(c1ccc2c(n1)CC1CCCCC1C2)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-methyl-5,5a,6,7,8,9,9a,10-octahydrobenzo[g]quinolin-2-amine?
The InChIKey is LCPQSGVGNYTEMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N2/c1-22(18-9-3-2-4-10-18)20-12-11-17-13-15-7-5-6-8-16(15)14-19(17)21-20/h11-12,15-16,18H,2-10,13-14H2,1H3.
What are the key properties of N-cyclohexyl-N-methyl-5,5a,6,7,8,9,9a,10-octahydrobenzo[g]quinolin-2-amine?
N-cyclohexyl-N-methyl-5,5a,6,7,8,9,9a,10-octahydrobenzo[g]quinolin-2-amine has a molecular weight of 298.47 g/mol, XLogP of 4.76, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-methyl-5,5a,6,7,8,9,9a,10-octahydrobenzo[g]quinolin-2-amine is sourced from PubChem (CID 141121657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).