6-bicyclo[3.1.0]hexanyl(quinolin-8-yl)methanamine

C16H18N2 — CID 105021197

IUPAC6-bicyclo[3.1.0]hexanyl(quinolin-8-yl)methanamine
SMILESNC(c1cccc2cccnc12)C1C2CCCC21
InChIInChI=1S/C16H18N2/c17-15(14-11-6-2-7-12(11)14)13-8-1-4-10-5-3-9-18-16(10)13/h1,3-5,8-9,11-12,14-15H,2,6-7,17H2
InChIKeyKECFDZMWDBJUHT-UHFFFAOYSA-N
MW238.33 g/mol
LogP3.28
Rot. Bonds2

About 6-bicyclo[3.1.0]hexanyl(quinolin-8-yl)methanamine

6-bicyclo[3.1.0]hexanyl(quinolin-8-yl)methanamine (PubChem CID 105021197) has the molecular formula C16H18N2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 6-bicyclo[3.1.0]hexanyl(quinolin-8-yl)methanamine.

Molecular Properties

Compound Name6-bicyclo[3.1.0]hexanyl(quinolin-8-yl)methanamine
PubChem CID105021197
Molecular FormulaC16H18N2
Molecular Weight238.33 g/mol
Exact Mass238.15
IUPAC Name6-bicyclo[3.1.0]hexanyl(quinolin-8-yl)methanamine
SMILESNC(c1cccc2cccnc12)C1C2CCCC21
InChIInChI=1S/C16H18N2/c17-15(14-11-6-2-7-12(11)14)13-8-1-4-10-5-3-9-18-16(10)13/h1,3-5,8-9,11-12,14-15H,2,6-7,17H2
InChIKeyKECFDZMWDBJUHT-UHFFFAOYSA-N
XLogP3.28
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[6-bicyclo[3.1.0]hexanyl(quinolin-8-yl)methyl]ethanamine
CID 105021311
(3,5-dimethylcyclohexyl)-quinolin-8-ylmethanamine
CID 105154267
1-quinolin-8-ylethane-1,2-diamine
CID 63968089
(3-ethylcyclopentyl)-quinolin-8-ylmethanamine
CID 81231414
2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-quinolin-8-ylethanamine
CID 115559387
1-cyclohexyl-2-quinolin-8-ylethane-1,2-diol
CID 103459066
1-cyclopentyl-N-methyl-1-quinolin-8-ylmethanamine
CID 81231662
6-bicyclo[3.1.0]hexanyl(quinolin-5-yl)methanol
CID 115826271
2-cyclopentyl-1-quinolin-8-ylethanol
CID 65149248
8-(dichloromethyl)quinoline
CID 19989328
2-amino-1-quinolin-8-ylpropan-1-ol
CID 63969290
1-cyclopropyl-N-methyl-1-quinolin-8-ylmethanamine
CID 81220023

Frequently Asked Questions

What is the IUPAC name of 6-bicyclo[3.1.0]hexanyl(quinolin-8-yl)methanamine?
The IUPAC name of 6-bicyclo[3.1.0]hexanyl(quinolin-8-yl)methanamine (CID 105021197) is 6-bicyclo[3.1.0]hexanyl(quinolin-8-yl)methanamine.
What is the SMILES notation for 6-bicyclo[3.1.0]hexanyl(quinolin-8-yl)methanamine?
The canonical SMILES for 6-bicyclo[3.1.0]hexanyl(quinolin-8-yl)methanamine is NC(c1cccc2cccnc12)C1C2CCCC21.
What is the InChIKey of 6-bicyclo[3.1.0]hexanyl(quinolin-8-yl)methanamine?
The InChIKey is KECFDZMWDBJUHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2/c17-15(14-11-6-2-7-12(11)14)13-8-1-4-10-5-3-9-18-16(10)13/h1,3-5,8-9,11-12,14-15H,2,6-7,17H2.
What are the key properties of 6-bicyclo[3.1.0]hexanyl(quinolin-8-yl)methanamine?
6-bicyclo[3.1.0]hexanyl(quinolin-8-yl)methanamine has a molecular weight of 238.33 g/mol, XLogP of 3.28, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bicyclo[3.1.0]hexanyl(quinolin-8-yl)methanamine is sourced from PubChem (CID 105021197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).