N-(6-bicyclo[3.2.0]hept-3-enyl)quinolin-3-amine

C16H16N2 — CID 43782745

IUPACN-(6-bicyclo[3.2.0]hept-3-enyl)quinolin-3-amine
SMILESC1=CC2C(C1)CC2Nc1cnc2ccccc2c1
InChIInChI=1S/C16H16N2/c1-2-7-15-12(4-1)8-13(10-17-15)18-16-9-11-5-3-6-14(11)16/h1-4,6-8,10-11,14,16,18H,5,9H2
InChIKeyAMNKNEAZABZUSF-UHFFFAOYSA-N
MW236.32 g/mol
LogP3.61
Rot. Bonds2

About N-(6-bicyclo[3.2.0]hept-3-enyl)quinolin-3-amine

N-(6-bicyclo[3.2.0]hept-3-enyl)quinolin-3-amine (PubChem CID 43782745) has the molecular formula C16H16N2 and a molecular weight of 236.32 g/mol. Its IUPAC name is N-(6-bicyclo[3.2.0]hept-3-enyl)quinolin-3-amine.

Molecular Properties

Compound NameN-(6-bicyclo[3.2.0]hept-3-enyl)quinolin-3-amine
PubChem CID43782745
Molecular FormulaC16H16N2
Molecular Weight236.32 g/mol
Exact Mass236.13
IUPAC NameN-(6-bicyclo[3.2.0]hept-3-enyl)quinolin-3-amine
SMILESC1=CC2C(C1)CC2Nc1cnc2ccccc2c1
InChIInChI=1S/C16H16N2/c1-2-7-15-12(4-1)8-13(10-17-15)18-16-9-11-5-3-6-14(11)16/h1-4,6-8,10-11,14,16,18H,5,9H2
InChIKeyAMNKNEAZABZUSF-UHFFFAOYSA-N
XLogP3.61
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-(2-ethylcyclopentyl)quinolin-3-amine
CID 113483363
4-N-quinolin-3-ylcyclohexane-1,4-diamine
CID 79724815
N-(3,4-diethoxyphenyl)bicyclo[3.2.0]hept-3-en-6-amine
CID 43760539
N-(4-bromo-3-fluorophenyl)bicyclo[3.2.0]hept-3-en-6-amine
CID 65437109
N-(1-methylpiperidin-4-yl)quinolin-3-amine
CID 43691175
N-quinolin-3-ylhydroxylamine
CID 54286324
N-[4-(6-bicyclo[3.2.0]hept-3-enylamino)phenyl]ethanesulfonamide
CID 60932516
N-bis(quinolin-3-ylamino)phosphorylquinolin-3-amine
CID 139034507
5-(6-bicyclo[3.2.0]hept-3-enylamino)-2-chlorobenzamide
CID 43784525
2-amino-N-quinolin-3-ylcyclopropane-1-carboxamide
CID 114995607
(1R,2S,3S,4R)-3-(quinolin-3-ylcarbamoyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
CID 18555567
N-[1-(2-bicyclo[2.2.1]hept-5-enyl)ethyl]quinolin-3-amine
CID 43782750

Frequently Asked Questions

What is the IUPAC name of N-(6-bicyclo[3.2.0]hept-3-enyl)quinolin-3-amine?
The IUPAC name of N-(6-bicyclo[3.2.0]hept-3-enyl)quinolin-3-amine (CID 43782745) is N-(6-bicyclo[3.2.0]hept-3-enyl)quinolin-3-amine.
What is the SMILES notation for N-(6-bicyclo[3.2.0]hept-3-enyl)quinolin-3-amine?
The canonical SMILES for N-(6-bicyclo[3.2.0]hept-3-enyl)quinolin-3-amine is C1=CC2C(C1)CC2Nc1cnc2ccccc2c1.
What is the InChIKey of N-(6-bicyclo[3.2.0]hept-3-enyl)quinolin-3-amine?
The InChIKey is AMNKNEAZABZUSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2/c1-2-7-15-12(4-1)8-13(10-17-15)18-16-9-11-5-3-6-14(11)16/h1-4,6-8,10-11,14,16,18H,5,9H2.
What are the key properties of N-(6-bicyclo[3.2.0]hept-3-enyl)quinolin-3-amine?
N-(6-bicyclo[3.2.0]hept-3-enyl)quinolin-3-amine has a molecular weight of 236.32 g/mol, XLogP of 3.61, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-bicyclo[3.2.0]hept-3-enyl)quinolin-3-amine is sourced from PubChem (CID 43782745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).