N-[2-(diethylamino)propyl]-2-(9-oxoacridin-10-yl)acetamide

C22H27N3O2 — CID 46433015

IUPACN-[2-(diethylamino)propyl]-2-(9-oxoacridin-10-yl)acetamide
SMILESCCN(CC)C(C)CNC(=O)Cn1c2ccccc2c(=O)c2ccccc21
InChIInChI=1S/C22H27N3O2/c1-4-24(5-2)16(3)14-23-21(26)15-25-19-12-8-6-10-17(19)22(27)18-11-7-9-13-20(18)25/h6-13,16H,4-5,14-15H2,1-3H3,(H,23,26)
InChIKeySMCLIEMYGSDGAG-UHFFFAOYSA-N
MW365.48 g/mol
LogP3.00
Rot. Bonds7

About N-[2-(diethylamino)propyl]-2-(9-oxoacridin-10-yl)acetamide

N-[2-(diethylamino)propyl]-2-(9-oxoacridin-10-yl)acetamide (PubChem CID 46433015) has the molecular formula C22H27N3O2 and a molecular weight of 365.48 g/mol. Its IUPAC name is N-[2-(diethylamino)propyl]-2-(9-oxoacridin-10-yl)acetamide.

Molecular Properties

Compound NameN-[2-(diethylamino)propyl]-2-(9-oxoacridin-10-yl)acetamide
PubChem CID46433015
Molecular FormulaC22H27N3O2
Molecular Weight365.48 g/mol
Exact Mass365.21
IUPAC NameN-[2-(diethylamino)propyl]-2-(9-oxoacridin-10-yl)acetamide
SMILESCCN(CC)C(C)CNC(=O)Cn1c2ccccc2c(=O)c2ccccc21
InChIInChI=1S/C22H27N3O2/c1-4-24(5-2)16(3)14-23-21(26)15-25-19-12-8-6-10-17(19)22(27)18-11-7-9-13-20(18)25/h6-13,16H,4-5,14-15H2,1-3H3,(H,23,26)
InChIKeySMCLIEMYGSDGAG-UHFFFAOYSA-N
XLogP3.00
TPSA54.34 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.48
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

N-[2-(diethylamino)-3-methylbutyl]-2-(9-oxoacridin-10-yl)acetamide
CID 43064735
N-[2-(diethylamino)-2-phenylethyl]-2-(9-oxoacridin-10-yl)acetamide
CID 42939371
N-[2-(diethylamino)-3-phenylpropyl]-2-(9-oxoacridin-10-yl)acetamide
CID 43063424
4-methyl-2-[[[2-(9-oxoacridin-10-yl)acetyl]amino]methyl]pentanoic acid
CID 120528483
N-(3-aminobutyl)-2-(9-oxoacridin-10-yl)acetamide
CID 119496675
2-(9-oxoacridin-10-yl)-N-(2-pyrrolidin-1-ylbutyl)acetamide
CID 43064818
N-[(2S)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(9-oxoacridin-10-yl)acetamide
CID 25488588
N-(3-ethyl-2-morpholin-4-ylpentyl)-2-(9-oxoacridin-10-yl)acetamide
CID 46410424
N-[(2R)-2-(2,6-dichlorophenyl)-2-hydroxyethyl]-2-(9-oxoacridin-10-yl)acetamide
CID 99810576
N-(2-methyl-1-phenylpropyl)-2-(9-oxoacridin-10-yl)acetamide
CID 16606060
N'-methyl-2-(9-oxoacridin-10-yl)-N'-phenylacetohydrazide
CID 25332872
N-[(4-acetamidophenyl)methyl]-2-(9-oxoacridin-10-yl)acetamide
CID 18154273

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)propyl]-2-(9-oxoacridin-10-yl)acetamide?
The IUPAC name of N-[2-(diethylamino)propyl]-2-(9-oxoacridin-10-yl)acetamide (CID 46433015) is N-[2-(diethylamino)propyl]-2-(9-oxoacridin-10-yl)acetamide.
What is the SMILES notation for N-[2-(diethylamino)propyl]-2-(9-oxoacridin-10-yl)acetamide?
The canonical SMILES for N-[2-(diethylamino)propyl]-2-(9-oxoacridin-10-yl)acetamide is CCN(CC)C(C)CNC(=O)Cn1c2ccccc2c(=O)c2ccccc21.
What is the InChIKey of N-[2-(diethylamino)propyl]-2-(9-oxoacridin-10-yl)acetamide?
The InChIKey is SMCLIEMYGSDGAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N3O2/c1-4-24(5-2)16(3)14-23-21(26)15-25-19-12-8-6-10-17(19)22(27)18-11-7-9-13-20(18)25/h6-13,16H,4-5,14-15H2,1-3H3,(H,23,26).
What are the key properties of N-[2-(diethylamino)propyl]-2-(9-oxoacridin-10-yl)acetamide?
N-[2-(diethylamino)propyl]-2-(9-oxoacridin-10-yl)acetamide has a molecular weight of 365.48 g/mol, XLogP of 3.00, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)propyl]-2-(9-oxoacridin-10-yl)acetamide is sourced from PubChem (CID 46433015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).