14H-cyclopenta[a]phenanthrene

C17H12 — CID 18702387

IUPAC14H-cyclopenta[a]phenanthrene
SMILESC1=CC2C(=C1)C=Cc1c2ccc2ccccc12
InChIInChI=1S/C17H12/c1-2-6-14-12(4-1)8-10-17-15-7-3-5-13(15)9-11-16(14)17/h1-11,15H
InChIKeyYETPMCUNOQQECD-UHFFFAOYSA-N
MW216.28 g/mol
LogP4.45
Rot. Bonds

About 14H-cyclopenta[a]phenanthrene

14H-cyclopenta[a]phenanthrene (PubChem CID 18702387) has the molecular formula C17H12 and a molecular weight of 216.28 g/mol. Its IUPAC name is 14H-cyclopenta[a]phenanthrene.

Molecular Properties

Compound Name14H-cyclopenta[a]phenanthrene
PubChem CID18702387
Molecular FormulaC17H12
Molecular Weight216.28 g/mol
Exact Mass216.09
IUPAC Name14H-cyclopenta[a]phenanthrene
SMILESC1=CC2C(=C1)C=Cc1c2ccc2ccccc12
InChIInChI=1S/C17H12/c1-2-6-14-12(4-1)8-10-17-15-7-3-5-13(15)9-11-16(14)17/h1-11,15H
InChIKeyYETPMCUNOQQECD-UHFFFAOYSA-N
XLogP4.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 14H-cyclopenta[a]phenanthrene?
The IUPAC name of 14H-cyclopenta[a]phenanthrene (CID 18702387) is 14H-cyclopenta[a]phenanthrene.
What is the SMILES notation for 14H-cyclopenta[a]phenanthrene?
The canonical SMILES for 14H-cyclopenta[a]phenanthrene is C1=CC2C(=C1)C=Cc1c2ccc2ccccc12.
What is the InChIKey of 14H-cyclopenta[a]phenanthrene?
The InChIKey is YETPMCUNOQQECD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12/c1-2-6-14-12(4-1)8-10-17-15-7-3-5-13(15)9-11-16(14)17/h1-11,15H.
What are the key properties of 14H-cyclopenta[a]phenanthrene?
14H-cyclopenta[a]phenanthrene has a molecular weight of 216.28 g/mol, XLogP of 4.45, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 14H-cyclopenta[a]phenanthrene is sourced from PubChem (CID 18702387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).