9-(ethylamino)-3,3-dimethyl-2,4-dihydroacridin-1-one;hydrochloride

C17H21ClN2O — CID 44668985

IUPAC9-(ethylamino)-3,3-dimethyl-2,4-dihydroacridin-1-one;hydrochloride
SMILESCCNc1c2c(nc3ccccc13)CC(C)(C)CC2=O.Cl
InChIInChI=1S/C17H20N2O.ClH/c1-4-18-16-11-7-5-6-8-12(11)19-13-9-17(2,3)10-14(20)15(13)16;/h5-8H,4,9-10H2,1-3H3,(H,18,19);1H
InChIKeyMFTBGPGVXNBULE-UHFFFAOYSA-N
MW304.82 g/mol
LogP4.24
Rot. Bonds2

About 9-(ethylamino)-3,3-dimethyl-2,4-dihydroacridin-1-one;hydrochloride

9-(ethylamino)-3,3-dimethyl-2,4-dihydroacridin-1-one;hydrochloride (PubChem CID 44668985) has the molecular formula C17H21ClN2O and a molecular weight of 304.82 g/mol. Its IUPAC name is 9-(ethylamino)-3,3-dimethyl-2,4-dihydroacridin-1-one;hydrochloride.

Molecular Properties

Compound Name9-(ethylamino)-3,3-dimethyl-2,4-dihydroacridin-1-one;hydrochloride
PubChem CID44668985
Molecular FormulaC17H21ClN2O
Molecular Weight304.82 g/mol
Exact Mass304.13
IUPAC Name9-(ethylamino)-3,3-dimethyl-2,4-dihydroacridin-1-one;hydrochloride
SMILESCCNc1c2c(nc3ccccc13)CC(C)(C)CC2=O.Cl
InChIInChI=1S/C17H20N2O.ClH/c1-4-18-16-11-7-5-6-8-12(11)19-13-9-17(2,3)10-14(20)15(13)16;/h5-8H,4,9-10H2,1-3H3,(H,18,19);1H
InChIKeyMFTBGPGVXNBULE-UHFFFAOYSA-N
XLogP4.24
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.82
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,3-dimethyl-2,4-dihydrophenazin-1-one
CID 12676417
12-(4-hydroxyphenyl)-9,9-dimethyl-8,10-dihydrobenzo[a]acridin-11-one
CID 135577930
N-ethylspiro[3,4-dihydro-1H-acridine-2,1'-cyclopentane]-9-amine
CID 21298180
3,3,5,7-tetramethyl-9-(octylamino)-2,4-dihydroacridin-1-one;hydrochloride
CID 52993132
ethane;N-ethyl-2,3-dimethylquinolin-4-amine
CID 142091780
3-hydroxy-5,5-dimethyl-2-[N-(phenanthridin-6-ylamino)-C-propylcarbonimidoyl]cyclohex-2-en-1-one
CID 135519574
2-anilino-4,7,7-trimethyl-6,8-dihydroquinazolin-5-one
CID 16583938
9-(hydroxyamino)-3,4-dihydro-2H-acridin-1-one
CID 54496209
4-(9,9-dimethyl-11-oxo-8,10-dihydrobenzo[a]acridin-12-yl)benzenediazonium
CID 10669455
9-[(2-hydroxy-2-phenylethyl)amino]-3,4-dihydro-2H-acridin-1-one
CID 54559789
N-ethyl-2,7,7-trimethyl-5-oxo-4-pyridin-2-yl-6,8-dihydroquinoline-3-carboxamide
CID 143246773
(Z)-but-2-enedioic acid;9-(butylamino)-3,3-dimethyl-2,4-dihydro-1H-acridin-1-ol
CID 6456060

Frequently Asked Questions

What is the IUPAC name of 9-(ethylamino)-3,3-dimethyl-2,4-dihydroacridin-1-one;hydrochloride?
The IUPAC name of 9-(ethylamino)-3,3-dimethyl-2,4-dihydroacridin-1-one;hydrochloride (CID 44668985) is 9-(ethylamino)-3,3-dimethyl-2,4-dihydroacridin-1-one;hydrochloride.
What is the SMILES notation for 9-(ethylamino)-3,3-dimethyl-2,4-dihydroacridin-1-one;hydrochloride?
The canonical SMILES for 9-(ethylamino)-3,3-dimethyl-2,4-dihydroacridin-1-one;hydrochloride is CCNc1c2c(nc3ccccc13)CC(C)(C)CC2=O.Cl.
What is the InChIKey of 9-(ethylamino)-3,3-dimethyl-2,4-dihydroacridin-1-one;hydrochloride?
The InChIKey is MFTBGPGVXNBULE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O.ClH/c1-4-18-16-11-7-5-6-8-12(11)19-13-9-17(2,3)10-14(20)15(13)16;/h5-8H,4,9-10H2,1-3H3,(H,18,19);1H.
What are the key properties of 9-(ethylamino)-3,3-dimethyl-2,4-dihydroacridin-1-one;hydrochloride?
9-(ethylamino)-3,3-dimethyl-2,4-dihydroacridin-1-one;hydrochloride has a molecular weight of 304.82 g/mol, XLogP of 4.24, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(ethylamino)-3,3-dimethyl-2,4-dihydroacridin-1-one;hydrochloride is sourced from PubChem (CID 44668985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).