N-ethyl-N-methyl-2-(2-quinolin-8-ylethylamino)acetamide

C16H21N3O — CID 81427020

IUPACN-ethyl-N-methyl-2-(2-quinolin-8-ylethylamino)acetamide
SMILESCCN(C)C(=O)CNCCc1cccc2cccnc12
InChIInChI=1S/C16H21N3O/c1-3-19(2)15(20)12-17-11-9-14-7-4-6-13-8-5-10-18-16(13)14/h4-8,10,17H,3,9,11-12H2,1-2H3
InChIKeyRPSNUEBYUIKCRF-UHFFFAOYSA-N
MW271.36 g/mol
LogP1.85
Rot. Bonds6

About N-ethyl-N-methyl-2-(2-quinolin-8-ylethylamino)acetamide

N-ethyl-N-methyl-2-(2-quinolin-8-ylethylamino)acetamide (PubChem CID 81427020) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is N-ethyl-N-methyl-2-(2-quinolin-8-ylethylamino)acetamide.

Molecular Properties

Compound NameN-ethyl-N-methyl-2-(2-quinolin-8-ylethylamino)acetamide
PubChem CID81427020
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC NameN-ethyl-N-methyl-2-(2-quinolin-8-ylethylamino)acetamide
SMILESCCN(C)C(=O)CNCCc1cccc2cccnc12
InChIInChI=1S/C16H21N3O/c1-3-19(2)15(20)12-17-11-9-14-7-4-6-13-8-5-10-18-16(13)14/h4-8,10,17H,3,9,11-12H2,1-2H3
InChIKeyRPSNUEBYUIKCRF-UHFFFAOYSA-N
XLogP1.85
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-ethyl-N-methyl-2-(2-quinolin-8-ylethylamino)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(Z)-3-methyl-4-(2-quinolin-8-ylethylamino)but-2-enoic acid
CID 103258778
2,2-dimethyl-3-(2-quinolin-8-ylethylamino)propanoic acid
CID 81426656
(Z)-2-ethyl-4-(2-quinolin-8-ylethylamino)but-2-enoic acid
CID 103258780
(E)-N-(2-quinolin-8-ylethyl)but-2-enamide
CID 112723855
1-(2-quinolin-8-ylethylamino)propan-2-ol
CID 81428765
methyl N-(2-quinolin-8-ylethyl)carbamate
CID 115577084
3-ethylsulfonyl-N-(2-quinolin-8-ylethyl)propan-1-amine
CID 81426941
N-methyl-2-quinolin-8-ylethanamine
CID 62549686
2-[(2-quinolin-8-ylethylamino)methyl]phenol
CID 78916472
(2R)-2-amino-N-(2-quinolin-8-ylethyl)propanamide
CID 78983595
2-(4-ethoxyphenoxy)-N-(2-quinolin-8-ylethyl)acetamide
CID 18149201
2-[2-oxo-2-(2-quinolin-8-ylethylamino)ethoxy]-N-(2-quinolin-8-ylethyl)acetamide
CID 78847250

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-2-(2-quinolin-8-ylethylamino)acetamide?
The IUPAC name of N-ethyl-N-methyl-2-(2-quinolin-8-ylethylamino)acetamide (CID 81427020) is N-ethyl-N-methyl-2-(2-quinolin-8-ylethylamino)acetamide.
What is the SMILES notation for N-ethyl-N-methyl-2-(2-quinolin-8-ylethylamino)acetamide?
The canonical SMILES for N-ethyl-N-methyl-2-(2-quinolin-8-ylethylamino)acetamide is CCN(C)C(=O)CNCCc1cccc2cccnc12.
What is the InChIKey of N-ethyl-N-methyl-2-(2-quinolin-8-ylethylamino)acetamide?
The InChIKey is RPSNUEBYUIKCRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c1-3-19(2)15(20)12-17-11-9-14-7-4-6-13-8-5-10-18-16(13)14/h4-8,10,17H,3,9,11-12H2,1-2H3.
What are the key properties of N-ethyl-N-methyl-2-(2-quinolin-8-ylethylamino)acetamide?
N-ethyl-N-methyl-2-(2-quinolin-8-ylethylamino)acetamide has a molecular weight of 271.36 g/mol, XLogP of 1.85, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-2-(2-quinolin-8-ylethylamino)acetamide is sourced from PubChem (CID 81427020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).