6-(9,9-dimethylfluoren-2-yl)-5,5-dimethyl-3,4-dihydro-2H-pyridine

C22H25N — CID 58983035

IUPAC6-(9,9-dimethylfluoren-2-yl)-5,5-dimethyl-3,4-dihydro-2H-pyridine
SMILESCC1(C)CCCN=C1c1ccc2c(c1)C(C)(C)c1ccccc1-2
InChIInChI=1S/C22H25N/c1-21(2)12-7-13-23-20(21)15-10-11-17-16-8-5-6-9-18(16)22(3,4)19(17)14-15/h5-6,8-11,14H,7,12-13H2,1-4H3
InChIKeyKAQUGFRVPXWQFI-UHFFFAOYSA-N
MW303.45 g/mol
LogP5.60
Rot. Bonds1

About 6-(9,9-dimethylfluoren-2-yl)-5,5-dimethyl-3,4-dihydro-2H-pyridine

6-(9,9-dimethylfluoren-2-yl)-5,5-dimethyl-3,4-dihydro-2H-pyridine (PubChem CID 58983035) has the molecular formula C22H25N and a molecular weight of 303.45 g/mol. Its IUPAC name is 6-(9,9-dimethylfluoren-2-yl)-5,5-dimethyl-3,4-dihydro-2H-pyridine.

Molecular Properties

Compound Name6-(9,9-dimethylfluoren-2-yl)-5,5-dimethyl-3,4-dihydro-2H-pyridine
PubChem CID58983035
Molecular FormulaC22H25N
Molecular Weight303.45 g/mol
Exact Mass303.20
IUPAC Name6-(9,9-dimethylfluoren-2-yl)-5,5-dimethyl-3,4-dihydro-2H-pyridine
SMILESCC1(C)CCCN=C1c1ccc2c(c1)C(C)(C)c1ccccc1-2
InChIInChI=1S/C22H25N/c1-21(2)12-7-13-23-20(21)15-10-11-17-16-8-5-6-9-18(16)22(3,4)19(17)14-15/h5-6,8-11,14H,7,12-13H2,1-4H3
InChIKeyKAQUGFRVPXWQFI-UHFFFAOYSA-N
XLogP5.60
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500303.45
LogP ≤ 55.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-(9,9-dimethylfluoren-2-yl)-5,5-dimethyl-3,4-dihydro-2H-pyridine?
The IUPAC name of 6-(9,9-dimethylfluoren-2-yl)-5,5-dimethyl-3,4-dihydro-2H-pyridine (CID 58983035) is 6-(9,9-dimethylfluoren-2-yl)-5,5-dimethyl-3,4-dihydro-2H-pyridine.
What is the SMILES notation for 6-(9,9-dimethylfluoren-2-yl)-5,5-dimethyl-3,4-dihydro-2H-pyridine?
The canonical SMILES for 6-(9,9-dimethylfluoren-2-yl)-5,5-dimethyl-3,4-dihydro-2H-pyridine is CC1(C)CCCN=C1c1ccc2c(c1)C(C)(C)c1ccccc1-2.
What is the InChIKey of 6-(9,9-dimethylfluoren-2-yl)-5,5-dimethyl-3,4-dihydro-2H-pyridine?
The InChIKey is KAQUGFRVPXWQFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N/c1-21(2)12-7-13-23-20(21)15-10-11-17-16-8-5-6-9-18(16)22(3,4)19(17)14-15/h5-6,8-11,14H,7,12-13H2,1-4H3.
What are the key properties of 6-(9,9-dimethylfluoren-2-yl)-5,5-dimethyl-3,4-dihydro-2H-pyridine?
6-(9,9-dimethylfluoren-2-yl)-5,5-dimethyl-3,4-dihydro-2H-pyridine has a molecular weight of 303.45 g/mol, XLogP of 5.60, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(9,9-dimethylfluoren-2-yl)-5,5-dimethyl-3,4-dihydro-2H-pyridine is sourced from PubChem (CID 58983035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).