7-quinolin-6-ylbicyclo[4.1.0]heptan-7-amine

C16H18N2 — CID 79331916

IUPAC7-quinolin-6-ylbicyclo[4.1.0]heptan-7-amine
SMILESNC1(c2ccc3ncccc3c2)C2CCCCC21
InChIInChI=1S/C16H18N2/c17-16(13-5-1-2-6-14(13)16)12-7-8-15-11(10-12)4-3-9-18-15/h3-4,7-10,13-14H,1-2,5-6,17H2
InChIKeyJRWFLDUGLWVWSG-UHFFFAOYSA-N
MW238.33 g/mol
LogP3.21
Rot. Bonds1

About 7-quinolin-6-ylbicyclo[4.1.0]heptan-7-amine

7-quinolin-6-ylbicyclo[4.1.0]heptan-7-amine (PubChem CID 79331916) has the molecular formula C16H18N2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 7-quinolin-6-ylbicyclo[4.1.0]heptan-7-amine.

Molecular Properties

Compound Name7-quinolin-6-ylbicyclo[4.1.0]heptan-7-amine
PubChem CID79331916
Molecular FormulaC16H18N2
Molecular Weight238.33 g/mol
Exact Mass238.15
IUPAC Name7-quinolin-6-ylbicyclo[4.1.0]heptan-7-amine
SMILESNC1(c2ccc3ncccc3c2)C2CCCCC21
InChIInChI=1S/C16H18N2/c17-16(13-5-1-2-6-14(13)16)12-7-8-15-11(10-12)4-3-9-18-15/h3-4,7-10,13-14H,1-2,5-6,17H2
InChIKeyJRWFLDUGLWVWSG-UHFFFAOYSA-N
XLogP3.21
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

7-quinoxalin-6-ylbicyclo[4.1.0]heptan-7-amine
CID 79330772
[cyclopentyl(quinolin-6-yl)methyl]hydrazine
CID 105204471
4-ethyl-1-quinolin-6-ylcyclohexan-1-amine
CID 81216009
7-pyrimidin-2-ylbicyclo[4.1.0]heptan-7-amine
CID 79331602
6-(2-cyclopropylazepan-2-yl)quinoline
CID 81229509
4-(methylamino)-1-quinolin-6-ylcyclohexan-1-ol
CID 81221437
6-(3-bromo-1-methylcyclopentyl)quinoline
CID 116540828
4-propan-2-yl-1-quinolin-6-ylcycloheptan-1-ol
CID 81196652
2-quinolin-6-ylcyclohexan-1-ol
CID 81223909
(4S)-2-amino-4,6-dimethyl-6-quinolin-6-yl-3,4-dihydropyridin-5-one
CID 145460831
2-ethyl-1-quinolin-6-ylcyclopropan-1-ol
CID 79333859
CID 87967042
CID 87967042

Frequently Asked Questions

What is the IUPAC name of 7-quinolin-6-ylbicyclo[4.1.0]heptan-7-amine?
The IUPAC name of 7-quinolin-6-ylbicyclo[4.1.0]heptan-7-amine (CID 79331916) is 7-quinolin-6-ylbicyclo[4.1.0]heptan-7-amine.
What is the SMILES notation for 7-quinolin-6-ylbicyclo[4.1.0]heptan-7-amine?
The canonical SMILES for 7-quinolin-6-ylbicyclo[4.1.0]heptan-7-amine is NC1(c2ccc3ncccc3c2)C2CCCCC21.
What is the InChIKey of 7-quinolin-6-ylbicyclo[4.1.0]heptan-7-amine?
The InChIKey is JRWFLDUGLWVWSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2/c17-16(13-5-1-2-6-14(13)16)12-7-8-15-11(10-12)4-3-9-18-15/h3-4,7-10,13-14H,1-2,5-6,17H2.
What are the key properties of 7-quinolin-6-ylbicyclo[4.1.0]heptan-7-amine?
7-quinolin-6-ylbicyclo[4.1.0]heptan-7-amine has a molecular weight of 238.33 g/mol, XLogP of 3.21, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-quinolin-6-ylbicyclo[4.1.0]heptan-7-amine is sourced from PubChem (CID 79331916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).