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

C19H25N3O — CID 166202902

IUPACN-cyclopentyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide
SMILESCCc1c(C)nc2ccccc2c1NCC(=O)NC1CCCC1
InChIInChI=1S/C19H25N3O/c1-3-15-13(2)21-17-11-7-6-10-16(17)19(15)20-12-18(23)22-14-8-4-5-9-14/h6-7,10-11,14H,3-5,8-9,12H2,1-2H3,(H,20,21)(H,22,23)
InChIKeyVSOHGGIZSJTFRA-UHFFFAOYSA-N
MW311.43 g/mol
LogP3.58
Rot. Bonds5

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

N-cyclopentyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide (PubChem CID 166202902) has the molecular formula C19H25N3O and a molecular weight of 311.43 g/mol. Its IUPAC name is N-cyclopentyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide
PubChem CID166202902
Molecular FormulaC19H25N3O
Molecular Weight311.43 g/mol
Exact Mass311.20
IUPAC NameN-cyclopentyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide
SMILESCCc1c(C)nc2ccccc2c1NCC(=O)NC1CCCC1
InChIInChI=1S/C19H25N3O/c1-3-15-13(2)21-17-11-7-6-10-16(17)19(15)20-12-18(23)22-14-8-4-5-9-14/h6-7,10-11,14H,3-5,8-9,12H2,1-2H3,(H,20,21)(H,22,23)
InChIKeyVSOHGGIZSJTFRA-UHFFFAOYSA-N
XLogP3.58
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 53.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide?
The IUPAC name of N-cyclopentyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide (CID 166202902) is N-cyclopentyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide.
What is the SMILES notation for N-cyclopentyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide?
The canonical SMILES for N-cyclopentyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide is CCc1c(C)nc2ccccc2c1NCC(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide?
The InChIKey is VSOHGGIZSJTFRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O/c1-3-15-13(2)21-17-11-7-6-10-16(17)19(15)20-12-18(23)22-14-8-4-5-9-14/h6-7,10-11,14H,3-5,8-9,12H2,1-2H3,(H,20,21)(H,22,23).
What are the key properties of N-cyclopentyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide?
N-cyclopentyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide has a molecular weight of 311.43 g/mol, XLogP of 3.58, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[(3-ethyl-2-methylquinolin-4-yl)amino]acetamide is sourced from PubChem (CID 166202902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).