1-cyclooctyl-N-methyl-1-quinolin-7-ylmethanamine

C19H26N2 — CID 81229901

IUPAC1-cyclooctyl-N-methyl-1-quinolin-7-ylmethanamine
SMILESCNC(c1ccc2cccnc2c1)C1CCCCCCC1
InChIInChI=1S/C19H26N2/c1-20-19(16-8-5-3-2-4-6-9-16)17-12-11-15-10-7-13-21-18(15)14-17/h7,10-14,16,19-20H,2-6,8-9H2,1H3
InChIKeyBGYGGKLGPILYSV-UHFFFAOYSA-N
MW282.43 g/mol
LogP4.86
Rot. Bonds3

About 1-cyclooctyl-N-methyl-1-quinolin-7-ylmethanamine

1-cyclooctyl-N-methyl-1-quinolin-7-ylmethanamine (PubChem CID 81229901) has the molecular formula C19H26N2 and a molecular weight of 282.43 g/mol. Its IUPAC name is 1-cyclooctyl-N-methyl-1-quinolin-7-ylmethanamine.

Molecular Properties

Compound Name1-cyclooctyl-N-methyl-1-quinolin-7-ylmethanamine
PubChem CID81229901
Molecular FormulaC19H26N2
Molecular Weight282.43 g/mol
Exact Mass282.21
IUPAC Name1-cyclooctyl-N-methyl-1-quinolin-7-ylmethanamine
SMILESCNC(c1ccc2cccnc2c1)C1CCCCCCC1
InChIInChI=1S/C19H26N2/c1-20-19(16-8-5-3-2-4-6-9-16)17-12-11-15-10-7-13-21-18(15)14-17/h7,10-14,16,19-20H,2-6,8-9H2,1H3
InChIKeyBGYGGKLGPILYSV-UHFFFAOYSA-N
XLogP4.86
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-quinolin-7-yl-1-(thiolan-3-yl)methanamine
CID 105172644
1-(3-ethylcyclopentyl)-N-methyl-1-quinolin-7-ylmethanamine
CID 81231705
cycloheptyl(quinolin-7-yl)methanol
CID 81216722
N-methyl-1-(4-methylcyclohexyl)-1-quinolin-6-ylmethanamine
CID 64776674
2-cyclohexylsulfanyl-N-methyl-1-quinolin-7-ylethanamine
CID 81228669
[cyclopentyl(quinolin-6-yl)methyl]hydrazine
CID 105204471
N-[cyclohexyl(quinolin-6-yl)methyl]propan-1-amine
CID 63095807
(2-cyclopentyl-1-quinolin-7-ylethyl)hydrazine
CID 105327558
1-(3,5-dimethylcyclohexyl)-N-methyl-1-quinolin-6-ylmethanamine
CID 64729922
N-methyl-1-(1,4-oxathian-2-yl)-1-quinolin-7-ylmethanamine
CID 81231155
1-cyclohexyl-N-methyl-1-pyridin-3-ylmethanamine
CID 60817955
1-cycloheptyl-N-methyl-1-(6-methyl-3-pyridinyl)methanamine
CID 65400041

Frequently Asked Questions

What is the IUPAC name of 1-cyclooctyl-N-methyl-1-quinolin-7-ylmethanamine?
The IUPAC name of 1-cyclooctyl-N-methyl-1-quinolin-7-ylmethanamine (CID 81229901) is 1-cyclooctyl-N-methyl-1-quinolin-7-ylmethanamine.
What is the SMILES notation for 1-cyclooctyl-N-methyl-1-quinolin-7-ylmethanamine?
The canonical SMILES for 1-cyclooctyl-N-methyl-1-quinolin-7-ylmethanamine is CNC(c1ccc2cccnc2c1)C1CCCCCCC1.
What is the InChIKey of 1-cyclooctyl-N-methyl-1-quinolin-7-ylmethanamine?
The InChIKey is BGYGGKLGPILYSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2/c1-20-19(16-8-5-3-2-4-6-9-16)17-12-11-15-10-7-13-21-18(15)14-17/h7,10-14,16,19-20H,2-6,8-9H2,1H3.
What are the key properties of 1-cyclooctyl-N-methyl-1-quinolin-7-ylmethanamine?
1-cyclooctyl-N-methyl-1-quinolin-7-ylmethanamine has a molecular weight of 282.43 g/mol, XLogP of 4.86, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclooctyl-N-methyl-1-quinolin-7-ylmethanamine is sourced from PubChem (CID 81229901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).