10cH-pyren-1-one

C16H10O — CID 57099205

IUPAC10cH-pyren-1-one
SMILESO=C1C=CC2=CC=C3C=CC=C4C=CC1=C2C43
InChIInChI=1S/C16H10O/c17-14-9-7-12-5-4-10-2-1-3-11-6-8-13(14)16(12)15(10)11/h1-9,15H
InChIKeyNJEZHIBGFAJTTF-UHFFFAOYSA-N
MW218.25 g/mol
LogP2.97
Rot. Bonds

About 10cH-pyren-1-one

10cH-pyren-1-one (PubChem CID 57099205) has the molecular formula C16H10O and a molecular weight of 218.25 g/mol. Its IUPAC name is 10cH-pyren-1-one.

Molecular Properties

Compound Name10cH-pyren-1-one
PubChem CID57099205
Molecular FormulaC16H10O
Molecular Weight218.25 g/mol
Exact Mass218.07
IUPAC Name10cH-pyren-1-one
SMILESO=C1C=CC2=CC=C3C=CC=C4C=CC1=C2C43
InChIInChI=1S/C16H10O/c17-14-9-7-12-5-4-10-2-1-3-11-6-8-13(14)16(12)15(10)11/h1-9,15H
InChIKeyNJEZHIBGFAJTTF-UHFFFAOYSA-N
XLogP2.97
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.25
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 10cH-pyren-1-one?
The IUPAC name of 10cH-pyren-1-one (CID 57099205) is 10cH-pyren-1-one.
What is the SMILES notation for 10cH-pyren-1-one?
The canonical SMILES for 10cH-pyren-1-one is O=C1C=CC2=CC=C3C=CC=C4C=CC1=C2C43.
What is the InChIKey of 10cH-pyren-1-one?
The InChIKey is NJEZHIBGFAJTTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10O/c17-14-9-7-12-5-4-10-2-1-3-11-6-8-13(14)16(12)15(10)11/h1-9,15H.
What are the key properties of 10cH-pyren-1-one?
10cH-pyren-1-one has a molecular weight of 218.25 g/mol, XLogP of 2.97, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10cH-pyren-1-one is sourced from PubChem (CID 57099205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).