3,3-dimethyl-2,4-dihydrophenazin-1-one

C14H14N2O — CID 12676417

IUPAC3,3-dimethyl-2,4-dihydrophenazin-1-one
SMILESCC1(C)CC(=O)c2nc3ccccc3nc2C1
InChIInChI=1S/C14H14N2O/c1-14(2)7-11-13(12(17)8-14)16-10-6-4-3-5-9(10)15-11/h3-6H,7-8H2,1-2H3
InChIKeyOSRZFTJBGCQVMS-UHFFFAOYSA-N
MW226.28 g/mol
LogP2.78
Rot. Bonds

About 3,3-dimethyl-2,4-dihydrophenazin-1-one

3,3-dimethyl-2,4-dihydrophenazin-1-one (PubChem CID 12676417) has the molecular formula C14H14N2O and a molecular weight of 226.28 g/mol. Its IUPAC name is 3,3-dimethyl-2,4-dihydrophenazin-1-one.

Molecular Properties

Compound Name3,3-dimethyl-2,4-dihydrophenazin-1-one
PubChem CID12676417
Molecular FormulaC14H14N2O
Molecular Weight226.28 g/mol
Exact Mass226.11
IUPAC Name3,3-dimethyl-2,4-dihydrophenazin-1-one
SMILESCC1(C)CC(=O)c2nc3ccccc3nc2C1
InChIInChI=1S/C14H14N2O/c1-14(2)7-11-13(12(17)8-14)16-10-6-4-3-5-9(10)15-11/h3-6H,7-8H2,1-2H3
InChIKeyOSRZFTJBGCQVMS-UHFFFAOYSA-N
XLogP2.78
TPSA42.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

9-(ethylamino)-3,3-dimethyl-2,4-dihydroacridin-1-one;hydrochloride
CID 44668985
2-benzyl-7,7-dimethyl-6,8-dihydroquinolin-5-one;hydrochloride
CID 69040452
12-(4-hydroxyphenyl)-9,9-dimethyl-8,10-dihydrobenzo[a]acridin-11-one
CID 135577930
7,7-dimethyl-2-(phenylsulfanylmethyl)-6,8-dihydroquinazolin-5-one
CID 65143399
2,6,6-trimethyl-5,7-dihydroquinolin-8-one
CID 123457653
2-anilino-4,7,7-trimethyl-6,8-dihydroquinazolin-5-one
CID 16583938
7,7-dimethyl-2-[(E)-2-phenylethenyl]-6,8-dihydroquinolin-5-one;hydrochloride
CID 69038380
2,7,7-trimethyl-5-oxo-4-phenyl-6,8-dihydroquinoline-3-carboxylic acid
CID 778088
9-cyclopropyl-3,3,6,6-tetramethyl-2,4,5,7-tetrahydroacridine-1,8-dione
CID 11997057
4-(9,9-dimethyl-11-oxo-8,10-dihydrobenzo[a]acridin-12-yl)benzenediazonium
CID 10669455
2-(2-ethylphenyl)-7,7-dimethyl-6,8-dihydroquinazolin-5-one
CID 62391065
4-anilino-7,7-dimethyl-2-phenyl-6,8-dihydroquinazolin-5-one
CID 91378745

Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-2,4-dihydrophenazin-1-one?
The IUPAC name of 3,3-dimethyl-2,4-dihydrophenazin-1-one (CID 12676417) is 3,3-dimethyl-2,4-dihydrophenazin-1-one.
What is the SMILES notation for 3,3-dimethyl-2,4-dihydrophenazin-1-one?
The canonical SMILES for 3,3-dimethyl-2,4-dihydrophenazin-1-one is CC1(C)CC(=O)c2nc3ccccc3nc2C1.
What is the InChIKey of 3,3-dimethyl-2,4-dihydrophenazin-1-one?
The InChIKey is OSRZFTJBGCQVMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O/c1-14(2)7-11-13(12(17)8-14)16-10-6-4-3-5-9(10)15-11/h3-6H,7-8H2,1-2H3.
What are the key properties of 3,3-dimethyl-2,4-dihydrophenazin-1-one?
3,3-dimethyl-2,4-dihydrophenazin-1-one has a molecular weight of 226.28 g/mol, XLogP of 2.78, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-2,4-dihydrophenazin-1-one is sourced from PubChem (CID 12676417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).