N-cyclobutyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide

C18H23N3O — CID 166382384

IUPACN-cyclobutyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide
SMILESCCc1c(C)nc2ccccc2c1NCC(=O)NC1CCC1
InChIInChI=1S/C18H23N3O/c1-3-14-12(2)20-16-10-5-4-9-15(16)18(14)19-11-17(22)21-13-7-6-8-13/h4-5,9-10,13H,3,6-8,11H2,1-2H3,(H,19,20)(H,21,22)
InChIKeyITOFMPMFWCUASG-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.19
Rot. Bonds5

About N-cyclobutyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide

N-cyclobutyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide (PubChem CID 166382384) has the molecular formula C18H23N3O and a molecular weight of 297.40 g/mol. Its IUPAC name is N-cyclobutyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide.

Molecular Properties

Compound NameN-cyclobutyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide
PubChem CID166382384
Molecular FormulaC18H23N3O
Molecular Weight297.40 g/mol
Exact Mass297.18
IUPAC NameN-cyclobutyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide
SMILESCCc1c(C)nc2ccccc2c1NCC(=O)NC1CCC1
InChIInChI=1S/C18H23N3O/c1-3-14-12(2)20-16-10-5-4-9-15(16)18(14)19-11-17(22)21-13-7-6-8-13/h4-5,9-10,13H,3,6-8,11H2,1-2H3,(H,19,20)(H,21,22)
InChIKeyITOFMPMFWCUASG-UHFFFAOYSA-N
XLogP3.19
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopentyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide
CID 166202902
N-[2-(cyclopropylamino)-2-oxoethyl]-2-(2,4-dimethylquinolin-3-yl)acetamide
CID 18163674
N-cyclopropyl-2-[(3-methylquinoxalin-2-yl)amino]acetamide
CID 60734132
2-(2,4-dimethylquinolin-3-yl)-N-(4-methylcyclohexyl)acetamide
CID 35006428
3-ethyl-2-methyl-N-(oxolan-3-yl)quinolin-4-amine
CID 133438561
4-[(3-ethyl-2-methylquinolin-4-yl)amino]-3,3-dimethylbutan-1-ol
CID 133438117
2-[(2-methyl-3-propan-2-ylquinolin-4-yl)amino]-N-propan-2-ylacetamide
CID 75452820
N-cycloheptyl-2-(2-ethylanilino)acetamide
CID 60631370
2-[4-(2-hydroxyethylamino)-2-methylquinolin-3-yl]acetic acid
CID 110432578
N-cyclopentyl-2-(2,6-difluoroanilino)acetamide
CID 28879037
N-cyclopropyl-2-(naphthalen-1-ylamino)acetamide
CID 26506369
1-[(3-ethyl-2-methylquinolin-4-yl)amino]-2-(1-methylpyrazol-4-yl)propan-2-ol
CID 133437963

Frequently Asked Questions

What is the IUPAC name of N-cyclobutyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide?
The IUPAC name of N-cyclobutyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide (CID 166382384) is N-cyclobutyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide.
What is the SMILES notation for N-cyclobutyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide?
The canonical SMILES for N-cyclobutyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide is CCc1c(C)nc2ccccc2c1NCC(=O)NC1CCC1.
What is the InChIKey of N-cyclobutyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide?
The InChIKey is ITOFMPMFWCUASG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O/c1-3-14-12(2)20-16-10-5-4-9-15(16)18(14)19-11-17(22)21-13-7-6-8-13/h4-5,9-10,13H,3,6-8,11H2,1-2H3,(H,19,20)(H,21,22).
What are the key properties of N-cyclobutyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide?
N-cyclobutyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide has a molecular weight of 297.40 g/mol, XLogP of 3.19, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide is sourced from PubChem (CID 166382384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).