N-[(2-quinolin-8-ylcyclobutyl)methyl]ethanamine

C16H20N2 — CID 81223017

IUPACN-[(2-quinolin-8-ylcyclobutyl)methyl]ethanamine
SMILESCCNCC1CCC1c1cccc2cccnc12
InChIInChI=1S/C16H20N2/c1-2-17-11-13-8-9-14(13)15-7-3-5-12-6-4-10-18-16(12)15/h3-7,10,13-14,17H,2,8-9,11H2,1H3
InChIKeyBHGVEUYBCNOWBR-UHFFFAOYSA-N
MW240.35 g/mol
LogP3.34
Rot. Bonds4

About N-[(2-quinolin-8-ylcyclobutyl)methyl]ethanamine

N-[(2-quinolin-8-ylcyclobutyl)methyl]ethanamine (PubChem CID 81223017) has the molecular formula C16H20N2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-[(2-quinolin-8-ylcyclobutyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(2-quinolin-8-ylcyclobutyl)methyl]ethanamine
PubChem CID81223017
Molecular FormulaC16H20N2
Molecular Weight240.35 g/mol
Exact Mass240.16
IUPAC NameN-[(2-quinolin-8-ylcyclobutyl)methyl]ethanamine
SMILESCCNCC1CCC1c1cccc2cccnc12
InChIInChI=1S/C16H20N2/c1-2-17-11-13-8-9-14(13)15-7-3-5-12-6-4-10-18-16(12)15/h3-7,10,13-14,17H,2,8-9,11H2,1H3
InChIKeyBHGVEUYBCNOWBR-UHFFFAOYSA-N
XLogP3.34
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2-quinolin-8-ylcyclopropyl)methyl]ethanamine
CID 63973584
N-[(2-isoquinolin-4-ylcyclobutyl)methyl]ethanamine
CID 81016883
N-[[2-(2-chlorophenyl)cyclobutyl]methyl]ethanamine
CID 81018227
N-[(2-naphthalen-1-ylcyclohexyl)methyl]ethanamine
CID 81028125
2-quinolin-8-ylcyclohexan-1-amine
CID 81224075
8-cyclopropylquinoline
CID 66823369
[4-(ethylaminomethyl)piperidin-1-yl]-quinolin-8-ylmethanone
CID 119646450
N-[(1-quinolin-8-ylsulfonylpiperidin-4-yl)methyl]ethanamine;hydrochloride
CID 119990230
2-methyl-N-[(2-quinolin-8-yloxolan-3-yl)methyl]propan-2-amine
CID 79370305
8-(2-chlorocycloheptyl)quinoline
CID 81223913
2-methyl-N-[(2-naphthalen-1-ylcyclobutyl)methyl]propan-1-amine
CID 81022663
N-[(2-quinolin-5-ylcyclobutyl)methyl]propan-2-amine
CID 81222405

Frequently Asked Questions

What is the IUPAC name of N-[(2-quinolin-8-ylcyclobutyl)methyl]ethanamine?
The IUPAC name of N-[(2-quinolin-8-ylcyclobutyl)methyl]ethanamine (CID 81223017) is N-[(2-quinolin-8-ylcyclobutyl)methyl]ethanamine.
What is the SMILES notation for N-[(2-quinolin-8-ylcyclobutyl)methyl]ethanamine?
The canonical SMILES for N-[(2-quinolin-8-ylcyclobutyl)methyl]ethanamine is CCNCC1CCC1c1cccc2cccnc12.
What is the InChIKey of N-[(2-quinolin-8-ylcyclobutyl)methyl]ethanamine?
The InChIKey is BHGVEUYBCNOWBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2/c1-2-17-11-13-8-9-14(13)15-7-3-5-12-6-4-10-18-16(12)15/h3-7,10,13-14,17H,2,8-9,11H2,1H3.
What are the key properties of N-[(2-quinolin-8-ylcyclobutyl)methyl]ethanamine?
N-[(2-quinolin-8-ylcyclobutyl)methyl]ethanamine has a molecular weight of 240.35 g/mol, XLogP of 3.34, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-quinolin-8-ylcyclobutyl)methyl]ethanamine is sourced from PubChem (CID 81223017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).