4-(dimethylamino)-N-(5-oxo-6,11-dihydroindeno[1,2-c]isoquinolin-10-yl)butanamide

C22H23N3O2 — CID 11847527

IUPAC4-(dimethylamino)-N-(5-oxo-6,11-dihydroindeno[1,2-c]isoquinolin-10-yl)butanamide
SMILESCN(C)CCCC(=O)Nc1cccc2c1Cc1c-2[nH]c(=O)c2ccccc12
InChIInChI=1S/C22H23N3O2/c1-25(2)12-6-11-20(26)23-19-10-5-9-15-17(19)13-18-14-7-3-4-8-16(14)22(27)24-21(15)18/h3-5,7-10H,6,11-13H2,1-2H3,(H,23,26)(H,24,27)
InChIKeyOIQGNXCIMMIGJM-UHFFFAOYSA-N
MW361.45 g/mol
LogP3.38
Rot. Bonds5

About 4-(dimethylamino)-N-(5-oxo-6,11-dihydroindeno[1,2-c]isoquinolin-10-yl)butanamide

4-(dimethylamino)-N-(5-oxo-6,11-dihydroindeno[1,2-c]isoquinolin-10-yl)butanamide (PubChem CID 11847527) has the molecular formula C22H23N3O2 and a molecular weight of 361.45 g/mol. Its IUPAC name is 4-(dimethylamino)-N-(5-oxo-6,11-dihydroindeno[1,2-c]isoquinolin-10-yl)butanamide.

Molecular Properties

Compound Name4-(dimethylamino)-N-(5-oxo-6,11-dihydroindeno[1,2-c]isoquinolin-10-yl)butanamide
PubChem CID11847527
Molecular FormulaC22H23N3O2
Molecular Weight361.45 g/mol
Exact Mass361.18
IUPAC Name4-(dimethylamino)-N-(5-oxo-6,11-dihydroindeno[1,2-c]isoquinolin-10-yl)butanamide
SMILESCN(C)CCCC(=O)Nc1cccc2c1Cc1c-2[nH]c(=O)c2ccccc12
InChIInChI=1S/C22H23N3O2/c1-25(2)12-6-11-20(26)23-19-10-5-9-15-17(19)13-18-14-7-3-4-8-16(14)22(27)24-21(15)18/h3-5,7-10H,6,11-13H2,1-2H3,(H,23,26)(H,24,27)
InChIKeyOIQGNXCIMMIGJM-UHFFFAOYSA-N
XLogP3.38
TPSA65.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.45
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-(dimethylamino)-N-(5-oxo-6,11-dihydroindeno[1,2-c]isoquinolin-10-yl)butanamide with MolForge

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Related Compounds

10-[(dimethylamino)methylsulfanyl]-6,11-dihydroindeno[1,2-c]isoquinolin-5-one
CID 46865692
4-(dimethylamino)-N-(5-methyl-1-oxo-2H-isoquinolin-3-yl)butanamide
CID 22931238
2-[2-(dimethylamino)ethyl-methylamino]-N-(7-oxo-6-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1,3,5(14),8,10,12-hexaen-2-yl)acetamide
CID 58777497
4-(dimethylamino)-N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]butanamide
CID 23449483
2-hydroxy-N-(5-oxo-6,11-dihydroindeno[1,2-c]isoquinolin-9-yl)acetamide
CID 11392596
3-(dimethylamino)-N-(2-methylphenyl)propanamide
CID 89469008
N-(2-cyanophenyl)-3-[3-(dimethylamino)propyl-methylamino]propanamide
CID 63694009
N-(7-oxo-2,5,8-triazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15),11,13-hexaen-14-yl)-2-phenylacetamide;hydrate
CID 19066045
3-[3-[3-(dimethylamino)propyl-methylamino]propanoyl]-1,2,4,5-tetrahydrobenzo[c][1,7]naphthyridin-6-one
CID 58913005
3-[acetyl-[3-(dimethylamino)propyl]amino]-N-(2-ethylphenyl)propanamide
CID 113117893
10-oxo-10-[(1-oxo-2,3-dihydroisoindol-4-yl)amino]decanoic acid
CID 71359584
1-[3-(dimethylamino)propyl]-3-naphthalen-1-ylurea;hydrochloride
CID 134126097

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-N-(5-oxo-6,11-dihydroindeno[1,2-c]isoquinolin-10-yl)butanamide?
The IUPAC name of 4-(dimethylamino)-N-(5-oxo-6,11-dihydroindeno[1,2-c]isoquinolin-10-yl)butanamide (CID 11847527) is 4-(dimethylamino)-N-(5-oxo-6,11-dihydroindeno[1,2-c]isoquinolin-10-yl)butanamide.
What is the SMILES notation for 4-(dimethylamino)-N-(5-oxo-6,11-dihydroindeno[1,2-c]isoquinolin-10-yl)butanamide?
The canonical SMILES for 4-(dimethylamino)-N-(5-oxo-6,11-dihydroindeno[1,2-c]isoquinolin-10-yl)butanamide is CN(C)CCCC(=O)Nc1cccc2c1Cc1c-2[nH]c(=O)c2ccccc12.
What is the InChIKey of 4-(dimethylamino)-N-(5-oxo-6,11-dihydroindeno[1,2-c]isoquinolin-10-yl)butanamide?
The InChIKey is OIQGNXCIMMIGJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O2/c1-25(2)12-6-11-20(26)23-19-10-5-9-15-17(19)13-18-14-7-3-4-8-16(14)22(27)24-21(15)18/h3-5,7-10H,6,11-13H2,1-2H3,(H,23,26)(H,24,27).
What are the key properties of 4-(dimethylamino)-N-(5-oxo-6,11-dihydroindeno[1,2-c]isoquinolin-10-yl)butanamide?
4-(dimethylamino)-N-(5-oxo-6,11-dihydroindeno[1,2-c]isoquinolin-10-yl)butanamide has a molecular weight of 361.45 g/mol, XLogP of 3.38, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-N-(5-oxo-6,11-dihydroindeno[1,2-c]isoquinolin-10-yl)butanamide is sourced from PubChem (CID 11847527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).