8-chloro-2,2-dimethyl-1,3,4,10-tetrahydroacridin-9-one

C15H16ClNO — CID 53362206

IUPAC8-chloro-2,2-dimethyl-1,3,4,10-tetrahydroacridin-9-one
SMILESCC1(C)CCc2[nH]c3cccc(Cl)c3c(=O)c2C1
InChIInChI=1S/C15H16ClNO/c1-15(2)7-6-11-9(8-15)14(18)13-10(16)4-3-5-12(13)17-11/h3-5H,6-8H2,1-2H3,(H,17,18)
InChIKeyCACPGGGQVAZFOX-UHFFFAOYSA-N
MW261.75 g/mol
LogP3.70
Rot. Bonds

About 8-chloro-2,2-dimethyl-1,3,4,10-tetrahydroacridin-9-one

8-chloro-2,2-dimethyl-1,3,4,10-tetrahydroacridin-9-one (PubChem CID 53362206) has the molecular formula C15H16ClNO and a molecular weight of 261.75 g/mol. Its IUPAC name is 8-chloro-2,2-dimethyl-1,3,4,10-tetrahydroacridin-9-one.

Molecular Properties

Compound Name8-chloro-2,2-dimethyl-1,3,4,10-tetrahydroacridin-9-one
PubChem CID53362206
Molecular FormulaC15H16ClNO
Molecular Weight261.75 g/mol
Exact Mass261.09
IUPAC Name8-chloro-2,2-dimethyl-1,3,4,10-tetrahydroacridin-9-one
SMILESCC1(C)CCc2[nH]c3cccc(Cl)c3c(=O)c2C1
InChIInChI=1S/C15H16ClNO/c1-15(2)7-6-11-9(8-15)14(18)13-10(16)4-3-5-12(13)17-11/h3-5H,6-8H2,1-2H3,(H,17,18)
InChIKeyCACPGGGQVAZFOX-UHFFFAOYSA-N
XLogP3.70
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.75
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1,2,3,4-Tetrahydroacridone
CID 95996
7-chloro-1,2,3,4-tetrahydroacridin-9(10H)-one
CID 13999807
Benzophenone, 2',5-dichloro-2-methylamino-
CID 21833
7-Chloro-2-methylquinolin-4-ol
CID 761550
DHOD Inhibitor, 2
CID 4037122
6,8-Dichloro-1,2,3,4-tetrahydro-acridin-9-ol
CID 53362376
7-Chloro-2-phenylquinolin-4-ol
CID 371056
GNF-Pf-3174
CID 410965
7-Chloro-2,8-dimethylquinolin-4-ol
CID 339445
4(1H)-Quinolinone, 5,7-dichloro-
CID 2736001
3-(3-Chloro-4-methylanilino)-5,5-dimethylcyclohex-2-en-1-one
CID 832306
6-Chloro-1,2,3,4,9,10-hexahydroacridin-9-one
CID 2870225

Frequently Asked Questions

What is the IUPAC name of 8-chloro-2,2-dimethyl-1,3,4,10-tetrahydroacridin-9-one?
The IUPAC name of 8-chloro-2,2-dimethyl-1,3,4,10-tetrahydroacridin-9-one (CID 53362206) is 8-chloro-2,2-dimethyl-1,3,4,10-tetrahydroacridin-9-one.
What is the SMILES notation for 8-chloro-2,2-dimethyl-1,3,4,10-tetrahydroacridin-9-one?
The canonical SMILES for 8-chloro-2,2-dimethyl-1,3,4,10-tetrahydroacridin-9-one is CC1(C)CCc2[nH]c3cccc(Cl)c3c(=O)c2C1.
What is the InChIKey of 8-chloro-2,2-dimethyl-1,3,4,10-tetrahydroacridin-9-one?
The InChIKey is CACPGGGQVAZFOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClNO/c1-15(2)7-6-11-9(8-15)14(18)13-10(16)4-3-5-12(13)17-11/h3-5H,6-8H2,1-2H3,(H,17,18).
What are the key properties of 8-chloro-2,2-dimethyl-1,3,4,10-tetrahydroacridin-9-one?
8-chloro-2,2-dimethyl-1,3,4,10-tetrahydroacridin-9-one has a molecular weight of 261.75 g/mol, XLogP of 3.70, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-2,2-dimethyl-1,3,4,10-tetrahydroacridin-9-one is sourced from PubChem (CID 53362206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).