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

C25H33N3O2 — CID 60524661

IUPACN-[2-(diethylamino)ethyl]-N-(2-methylpropyl)-2-(9-oxoacridin-10-yl)acetamide
SMILESCCN(CC)CCN(CC(C)C)C(=O)Cn1c2ccccc2c(=O)c2ccccc21
InChIInChI=1S/C25H33N3O2/c1-5-26(6-2)15-16-27(17-19(3)4)24(29)18-28-22-13-9-7-11-20(22)25(30)21-12-8-10-14-23(21)28/h7-14,19H,5-6,15-18H2,1-4H3
InChIKeyASQSKCVEWCELNK-UHFFFAOYSA-N
MW407.56 g/mol
LogP3.98
Rot. Bonds9

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

N-[2-(diethylamino)ethyl]-N-(2-methylpropyl)-2-(9-oxoacridin-10-yl)acetamide (PubChem CID 60524661) has the molecular formula C25H33N3O2 and a molecular weight of 407.56 g/mol. Its IUPAC name is N-[2-(diethylamino)ethyl]-N-(2-methylpropyl)-2-(9-oxoacridin-10-yl)acetamide.

Molecular Properties

Compound NameN-[2-(diethylamino)ethyl]-N-(2-methylpropyl)-2-(9-oxoacridin-10-yl)acetamide
PubChem CID60524661
Molecular FormulaC25H33N3O2
Molecular Weight407.56 g/mol
Exact Mass407.26
IUPAC NameN-[2-(diethylamino)ethyl]-N-(2-methylpropyl)-2-(9-oxoacridin-10-yl)acetamide
SMILESCCN(CC)CCN(CC(C)C)C(=O)Cn1c2ccccc2c(=O)c2ccccc21
InChIInChI=1S/C25H33N3O2/c1-5-26(6-2)15-16-27(17-19(3)4)24(29)18-28-22-13-9-7-11-20(22)25(30)21-12-8-10-14-23(21)28/h7-14,19H,5-6,15-18H2,1-4H3
InChIKeyASQSKCVEWCELNK-UHFFFAOYSA-N
XLogP3.98
TPSA45.55 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.56
LogP ≤ 53.98
H-Bond Donors ≤ 50
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)ethyl]-N-(2-methylpropyl)-2-(4-oxocinnolin-1-yl)acetamide
CID 60557343
N-methyl-N-[(2S)-4-methylpentan-2-yl]-2-(9-oxoacridin-10-yl)acetamide
CID 25348614
2-carbazol-9-yl-N,N-dipropylacetamide
CID 14874688
10-(2-methylpropyl)acridin-9-one
CID 59742563
N-[[4-(dimethylamino)phenyl]methyl]-N-ethyl-2-(9-oxoacridin-10-yl)acetamide
CID 52553414
N-(2-hydroxyethyl)-N-methyl-2-(9-oxoacridin-10-yl)acetamide
CID 110885996
N-[(3,4-difluorophenyl)methyl]-N-[2-(dimethylamino)ethyl]-2-(9-oxoacridin-10-yl)acetamide
CID 60598710
N-[2-(diethylamino)propyl]-2-(9-oxoacridin-10-yl)acetamide
CID 46433015
N-[2-(diethylamino)-3-methylbutyl]-2-(9-oxoacridin-10-yl)acetamide
CID 43064735
2-(9-oxoacridin-10-yl)acetyl chloride
CID 15839148
N-(3-aminobutyl)-2-(9-oxoacridin-10-yl)acetamide
CID 119496675
N-[1-(2,4-dichlorophenyl)ethyl]-N-methyl-2-(9-oxoacridin-10-yl)acetamide
CID 46588611

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)ethyl]-N-(2-methylpropyl)-2-(9-oxoacridin-10-yl)acetamide?
The IUPAC name of N-[2-(diethylamino)ethyl]-N-(2-methylpropyl)-2-(9-oxoacridin-10-yl)acetamide (CID 60524661) is N-[2-(diethylamino)ethyl]-N-(2-methylpropyl)-2-(9-oxoacridin-10-yl)acetamide.
What is the SMILES notation for N-[2-(diethylamino)ethyl]-N-(2-methylpropyl)-2-(9-oxoacridin-10-yl)acetamide?
The canonical SMILES for N-[2-(diethylamino)ethyl]-N-(2-methylpropyl)-2-(9-oxoacridin-10-yl)acetamide is CCN(CC)CCN(CC(C)C)C(=O)Cn1c2ccccc2c(=O)c2ccccc21.
What is the InChIKey of N-[2-(diethylamino)ethyl]-N-(2-methylpropyl)-2-(9-oxoacridin-10-yl)acetamide?
The InChIKey is ASQSKCVEWCELNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H33N3O2/c1-5-26(6-2)15-16-27(17-19(3)4)24(29)18-28-22-13-9-7-11-20(22)25(30)21-12-8-10-14-23(21)28/h7-14,19H,5-6,15-18H2,1-4H3.
What are the key properties of N-[2-(diethylamino)ethyl]-N-(2-methylpropyl)-2-(9-oxoacridin-10-yl)acetamide?
N-[2-(diethylamino)ethyl]-N-(2-methylpropyl)-2-(9-oxoacridin-10-yl)acetamide has a molecular weight of 407.56 g/mol, XLogP of 3.98, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)ethyl]-N-(2-methylpropyl)-2-(9-oxoacridin-10-yl)acetamide is sourced from PubChem (CID 60524661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).