7-(9H-fluoren-2-yl)-3-oxa-9-azabicyclo[3.3.1]non-6-ene

C20H19NO — CID 171973343

IUPAC7-(9H-fluoren-2-yl)-3-oxa-9-azabicyclo[3.3.1]non-6-ene
SMILESC1=C(c2ccc3c(c2)Cc2ccccc2-3)CC2COCC1N2
InChIInChI=1S/C20H19NO/c1-2-4-19-14(3-1)8-16-7-13(5-6-20(16)19)15-9-17-11-22-12-18(10-15)21-17/h1-7,9,17-18,21H,8,10-12H2
InChIKeyBYCVUDPANAHCEJ-UHFFFAOYSA-N
MW289.38 g/mol
LogP3.40
Rot. Bonds1

About 7-(9H-fluoren-2-yl)-3-oxa-9-azabicyclo[3.3.1]non-6-ene

7-(9H-fluoren-2-yl)-3-oxa-9-azabicyclo[3.3.1]non-6-ene (PubChem CID 171973343) has the molecular formula C20H19NO and a molecular weight of 289.38 g/mol. Its IUPAC name is 7-(9H-fluoren-2-yl)-3-oxa-9-azabicyclo[3.3.1]non-6-ene.

Molecular Properties

Compound Name7-(9H-fluoren-2-yl)-3-oxa-9-azabicyclo[3.3.1]non-6-ene
PubChem CID171973343
Molecular FormulaC20H19NO
Molecular Weight289.38 g/mol
Exact Mass289.15
IUPAC Name7-(9H-fluoren-2-yl)-3-oxa-9-azabicyclo[3.3.1]non-6-ene
SMILESC1=C(c2ccc3c(c2)Cc2ccccc2-3)CC2COCC1N2
InChIInChI=1S/C20H19NO/c1-2-4-19-14(3-1)8-16-7-13(5-6-20(16)19)15-9-17-11-22-12-18(10-15)21-17/h1-7,9,17-18,21H,8,10-12H2
InChIKeyBYCVUDPANAHCEJ-UHFFFAOYSA-N
XLogP3.40
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 7-(9H-fluoren-2-yl)-3-oxa-9-azabicyclo[3.3.1]non-6-ene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[3-(3-oxa-9-azabicyclo[3.3.1]non-6-en-7-yl)phenyl]cyclopropane-1-carbonitrile
CID 171974692
1-[4-(3-oxa-9-azabicyclo[3.3.1]non-6-en-7-yl)phenyl]cyclopropane-1-carbonitrile
CID 171974695
7-(5-phenylmethoxy-3-pyridinyl)-3-oxa-9-azabicyclo[3.3.1]non-6-ene
CID 171972999
3-(9H-fluoren-2-yl)-9-methyl-9-azabicyclo[3.3.1]non-2-ene
CID 171972376
2-(9H-fluoren-2-yl)-1H-pyrrole
CID 21095785
(3S)-3-(9H-fluoren-2-yl)morpholine
CID 171193402
nonacyclo[18.14.0.03,18.04,16.06,14.08,13.021,33.023,31.025,30]tetratriaconta-1,3(18),4(16),5,8,10,12,14,19,21(33),22,25,27,29,31-pentadecaene
CID 59863436
ethene;9H-fluorene
CID 159544077
2,5-bis(9H-fluoren-2-yl)thieno[3,2-b]thiophene
CID 59779545
9-(9H-fluoren-2-yl)-10-phenylanthracene
CID 59866453
3-phenyl-9-azabicyclo[3.3.1]non-2-ene
CID 70023991
9H-fluorene;9-methyltetracyclo[6.5.0.04,12.05,10]trideca-1(13),2,4(12),5(10),6,8-hexaene
CID 173160450

Frequently Asked Questions

What is the IUPAC name of 7-(9H-fluoren-2-yl)-3-oxa-9-azabicyclo[3.3.1]non-6-ene?
The IUPAC name of 7-(9H-fluoren-2-yl)-3-oxa-9-azabicyclo[3.3.1]non-6-ene (CID 171973343) is 7-(9H-fluoren-2-yl)-3-oxa-9-azabicyclo[3.3.1]non-6-ene.
What is the SMILES notation for 7-(9H-fluoren-2-yl)-3-oxa-9-azabicyclo[3.3.1]non-6-ene?
The canonical SMILES for 7-(9H-fluoren-2-yl)-3-oxa-9-azabicyclo[3.3.1]non-6-ene is C1=C(c2ccc3c(c2)Cc2ccccc2-3)CC2COCC1N2.
What is the InChIKey of 7-(9H-fluoren-2-yl)-3-oxa-9-azabicyclo[3.3.1]non-6-ene?
The InChIKey is BYCVUDPANAHCEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO/c1-2-4-19-14(3-1)8-16-7-13(5-6-20(16)19)15-9-17-11-22-12-18(10-15)21-17/h1-7,9,17-18,21H,8,10-12H2.
What are the key properties of 7-(9H-fluoren-2-yl)-3-oxa-9-azabicyclo[3.3.1]non-6-ene?
7-(9H-fluoren-2-yl)-3-oxa-9-azabicyclo[3.3.1]non-6-ene has a molecular weight of 289.38 g/mol, XLogP of 3.40, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(9H-fluoren-2-yl)-3-oxa-9-azabicyclo[3.3.1]non-6-ene is sourced from PubChem (CID 171973343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).