6-azatricyclo[9.4.0.03,8]pentadeca-3,5,8,10,12,14-hexaen-2-amine

C14H14N2 — CID 91398657

IUPAC6-azatricyclo[9.4.0.03,8]pentadeca-3,5,8,10,12,14-hexaen-2-amine
SMILESNC1C2=CC=NCC2=CC=C2C=CC=CC21
InChIInChI=1S/C14H14N2/c15-14-12-4-2-1-3-10(12)5-6-11-9-16-8-7-13(11)14/h1-8,12,14H,9,15H2
InChIKeyRCUOTJULSWVRDA-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.93
Rot. Bonds

About 6-azatricyclo[9.4.0.03,8]pentadeca-3,5,8,10,12,14-hexaen-2-amine

6-azatricyclo[9.4.0.03,8]pentadeca-3,5,8,10,12,14-hexaen-2-amine (PubChem CID 91398657) has the molecular formula C14H14N2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 6-azatricyclo[9.4.0.03,8]pentadeca-3,5,8,10,12,14-hexaen-2-amine.

Molecular Properties

Compound Name6-azatricyclo[9.4.0.03,8]pentadeca-3,5,8,10,12,14-hexaen-2-amine
PubChem CID91398657
Molecular FormulaC14H14N2
Molecular Weight210.28 g/mol
Exact Mass210.12
IUPAC Name6-azatricyclo[9.4.0.03,8]pentadeca-3,5,8,10,12,14-hexaen-2-amine
SMILESNC1C2=CC=NCC2=CC=C2C=CC=CC21
InChIInChI=1S/C14H14N2/c15-14-12-4-2-1-3-10(12)5-6-11-9-16-8-7-13(11)14/h1-8,12,14H,9,15H2
InChIKeyRCUOTJULSWVRDA-UHFFFAOYSA-N
XLogP1.93
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6-azatricyclo[9.4.0.03,8]pentadeca-3,5,8,10,12,14-hexaen-2-amine with MolForge

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Related Compounds

6,7,8,8a-Tetrahydroquinolin-7-amine
CID 57218060
7,8-dihydro-6H-quinolin-8a-amine
CID 67645554
2,3-dihydro-1H-benzo[d][1]benzazepin-1-amine
CID 87914886
2-Imino-1-(6-methylcyclohexa-1,3-dien-1-yl)ethanamine
CID 89153800
(1R)-2-[(1S)-cyclohexa-2,4-dien-1-yl]-1-(3,4-dihydropyridin-5-yl)ethanamine
CID 89864824
2-[2-(4-methylcyclohexa-2,4-dien-1-yl)ethyl]-2H-pyridin-1-ium
CID 91135166
4,5,5a,9a-tetrahydro-3H-1-benzazepin-5-amine
CID 91203258
2-Cyclohexa-1,3-dien-1-yl-3-methyl-2,3-dihydropyridine
CID 138467804
(E)-5-(3,4-dimethylpentylimino)-3-ethenylpent-3-en-2-amine
CID 138702998
8a-methyl-7,8-dihydro-6H-quinolin-8-amine
CID 139310310
5-(1,2-Dihydropyridin-5-yl)-6-(2,3-dihydropyridin-2-yl)-2,5-dihydropyridine
CID 141002609
8,8a-Dihydroquinolin-8-ylmethanamine
CID 143636709

Frequently Asked Questions

What is the IUPAC name of 6-azatricyclo[9.4.0.03,8]pentadeca-3,5,8,10,12,14-hexaen-2-amine?
The IUPAC name of 6-azatricyclo[9.4.0.03,8]pentadeca-3,5,8,10,12,14-hexaen-2-amine (CID 91398657) is 6-azatricyclo[9.4.0.03,8]pentadeca-3,5,8,10,12,14-hexaen-2-amine.
What is the SMILES notation for 6-azatricyclo[9.4.0.03,8]pentadeca-3,5,8,10,12,14-hexaen-2-amine?
The canonical SMILES for 6-azatricyclo[9.4.0.03,8]pentadeca-3,5,8,10,12,14-hexaen-2-amine is NC1C2=CC=NCC2=CC=C2C=CC=CC21.
What is the InChIKey of 6-azatricyclo[9.4.0.03,8]pentadeca-3,5,8,10,12,14-hexaen-2-amine?
The InChIKey is RCUOTJULSWVRDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2/c15-14-12-4-2-1-3-10(12)5-6-11-9-16-8-7-13(11)14/h1-8,12,14H,9,15H2.
What are the key properties of 6-azatricyclo[9.4.0.03,8]pentadeca-3,5,8,10,12,14-hexaen-2-amine?
6-azatricyclo[9.4.0.03,8]pentadeca-3,5,8,10,12,14-hexaen-2-amine has a molecular weight of 210.28 g/mol, XLogP of 1.93, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-azatricyclo[9.4.0.03,8]pentadeca-3,5,8,10,12,14-hexaen-2-amine is sourced from PubChem (CID 91398657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).