1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-quinolin-5-ylmethanamine

C18H22N2 — CID 105020098

IUPAC1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-quinolin-5-ylmethanamine
SMILESCNC(c1cccc2ncccc12)C1C2CCCCC21
InChIInChI=1S/C18H22N2/c1-19-18(17-13-6-2-3-7-14(13)17)15-8-4-10-16-12(15)9-5-11-20-16/h4-5,8-11,13-14,17-19H,2-3,6-7H2,1H3
InChIKeyWGUYOUPXKCVSIL-UHFFFAOYSA-N
MW266.39 g/mol
LogP3.93
Rot. Bonds3

About 1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-quinolin-5-ylmethanamine

1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-quinolin-5-ylmethanamine (PubChem CID 105020098) has the molecular formula C18H22N2 and a molecular weight of 266.39 g/mol. Its IUPAC name is 1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-quinolin-5-ylmethanamine.

Molecular Properties

Compound Name1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-quinolin-5-ylmethanamine
PubChem CID105020098
Molecular FormulaC18H22N2
Molecular Weight266.39 g/mol
Exact Mass266.18
IUPAC Name1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-quinolin-5-ylmethanamine
SMILESCNC(c1cccc2ncccc12)C1C2CCCCC21
InChIInChI=1S/C18H22N2/c1-19-18(17-13-6-2-3-7-14(13)17)15-8-4-10-16-12(15)9-5-11-20-16/h4-5,8-11,13-14,17-19H,2-3,6-7H2,1H3
InChIKeyWGUYOUPXKCVSIL-UHFFFAOYSA-N
XLogP3.93
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-bicyclo[3.1.0]hexanyl(quinolin-5-yl)methanol
CID 115826271
1-(5,6-dimethyl-1,4-dithian-2-yl)-N-methyl-1-quinolin-5-ylmethanamine
CID 103345763
N-methyl-1-(4-methylmorpholin-2-yl)-1-quinolin-5-ylmethanamine
CID 81231144
1-cyclohexyl-2-quinolin-5-ylethane-1,2-diol
CID 103459285
[(5-methyloxolan-2-yl)-quinolin-5-ylmethyl]hydrazine
CID 105326995
[6-bicyclo[3.1.0]hexanyl(naphthalen-1-yl)methyl]hydrazine
CID 105301264
N-methyl-1-quinolin-5-yl-2-(thian-4-yl)ethanamine
CID 105171945
CID 158967293
CID 158967293
1-(2-iodophenyl)-N-methyl-1-quinolin-5-ylmethanamine
CID 105020092
[quinolin-5-yl(thiolan-3-yl)methyl]hydrazine
CID 105327009
3-cyclopentyl-1-quinolin-5-ylpropan-1-amine
CID 105020216
1-(6-bicyclo[3.1.0]hexanyl)-1-(2-cyclobutylphenyl)-N-methylmethanamine
CID 105052166

Frequently Asked Questions

What is the IUPAC name of 1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-quinolin-5-ylmethanamine?
The IUPAC name of 1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-quinolin-5-ylmethanamine (CID 105020098) is 1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-quinolin-5-ylmethanamine.
What is the SMILES notation for 1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-quinolin-5-ylmethanamine?
The canonical SMILES for 1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-quinolin-5-ylmethanamine is CNC(c1cccc2ncccc12)C1C2CCCCC21.
What is the InChIKey of 1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-quinolin-5-ylmethanamine?
The InChIKey is WGUYOUPXKCVSIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2/c1-19-18(17-13-6-2-3-7-14(13)17)15-8-4-10-16-12(15)9-5-11-20-16/h4-5,8-11,13-14,17-19H,2-3,6-7H2,1H3.
What are the key properties of 1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-quinolin-5-ylmethanamine?
1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-quinolin-5-ylmethanamine has a molecular weight of 266.39 g/mol, XLogP of 3.93, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-quinolin-5-ylmethanamine is sourced from PubChem (CID 105020098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).