5,6,6-trimethylphenanthridine

C16H17N — CID 153320066

IUPAC5,6,6-trimethylphenanthridine
SMILESCN1c2ccccc2-c2ccccc2C1(C)C
InChIInChI=1S/C16H17N/c1-16(2)14-10-6-4-8-12(14)13-9-5-7-11-15(13)17(16)3/h4-11H,1-3H3
InChIKeyFXLWPYWOKRWNBF-UHFFFAOYSA-N
MW223.32 g/mol
LogP4.04
Rot. Bonds

About 5,6,6-trimethylphenanthridine

5,6,6-trimethylphenanthridine (PubChem CID 153320066) has the molecular formula C16H17N and a molecular weight of 223.32 g/mol. Its IUPAC name is 5,6,6-trimethylphenanthridine.

Molecular Properties

Compound Name5,6,6-trimethylphenanthridine
PubChem CID153320066
Molecular FormulaC16H17N
Molecular Weight223.32 g/mol
Exact Mass223.14
IUPAC Name5,6,6-trimethylphenanthridine
SMILESCN1c2ccccc2-c2ccccc2C1(C)C
InChIInChI=1S/C16H17N/c1-16(2)14-10-6-4-8-12(14)13-9-5-7-11-15(13)17(16)3/h4-11H,1-3H3
InChIKeyFXLWPYWOKRWNBF-UHFFFAOYSA-N
XLogP4.04
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 139245935
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CID 91014765
3,3-dimethyl-2-oxidoisoindol-1-one
CID 172579170
methane;9-methylfluoren-9-ol
CID 160708378
10,10,14,14,15,15,22-heptamethyl-22-azapentacyclo[11.9.0.03,11.04,9.016,21]docosa-1(13),2,4,6,8,11,16,18,20-nonaene
CID 58184992

Frequently Asked Questions

What is the IUPAC name of 5,6,6-trimethylphenanthridine?
The IUPAC name of 5,6,6-trimethylphenanthridine (CID 153320066) is 5,6,6-trimethylphenanthridine.
What is the SMILES notation for 5,6,6-trimethylphenanthridine?
The canonical SMILES for 5,6,6-trimethylphenanthridine is CN1c2ccccc2-c2ccccc2C1(C)C.
What is the InChIKey of 5,6,6-trimethylphenanthridine?
The InChIKey is FXLWPYWOKRWNBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N/c1-16(2)14-10-6-4-8-12(14)13-9-5-7-11-15(13)17(16)3/h4-11H,1-3H3.
What are the key properties of 5,6,6-trimethylphenanthridine?
5,6,6-trimethylphenanthridine has a molecular weight of 223.32 g/mol, XLogP of 4.04, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6,6-trimethylphenanthridine is sourced from PubChem (CID 153320066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).