6-amino-N-(2-methoxyethyl)-2-methylquinoline-4-carboxamide

C14H17N3O2 — CID 110489408

IUPAC6-amino-N-(2-methoxyethyl)-2-methylquinoline-4-carboxamide
SMILESCOCCNC(=O)c1cc(C)nc2ccc(N)cc12
InChIInChI=1S/C14H17N3O2/c1-9-7-12(14(18)16-5-6-19-2)11-8-10(15)3-4-13(11)17-9/h3-4,7-8H,5-6,15H2,1-2H3,(H,16,18)
InChIKeyOYAIAUCYYKMKTM-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.50
Rot. Bonds4

About 6-amino-N-(2-methoxyethyl)-2-methylquinoline-4-carboxamide

6-amino-N-(2-methoxyethyl)-2-methylquinoline-4-carboxamide (PubChem CID 110489408) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is 6-amino-N-(2-methoxyethyl)-2-methylquinoline-4-carboxamide.

Molecular Properties

Compound Name6-amino-N-(2-methoxyethyl)-2-methylquinoline-4-carboxamide
PubChem CID110489408
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name6-amino-N-(2-methoxyethyl)-2-methylquinoline-4-carboxamide
SMILESCOCCNC(=O)c1cc(C)nc2ccc(N)cc12
InChIInChI=1S/C14H17N3O2/c1-9-7-12(14(18)16-5-6-19-2)11-8-10(15)3-4-13(11)17-9/h3-4,7-8H,5-6,15H2,1-2H3,(H,16,18)
InChIKeyOYAIAUCYYKMKTM-UHFFFAOYSA-N
XLogP1.50
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 6-amino-N-(2-methoxyethyl)-2-methylquinoline-4-carboxamide 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

6-bromo-N-(2-methoxyethyl)-2-methylquinoline-4-carboxamide
CID 46291474
6-amino-N-ethyl-2-methylquinoline-4-carboxamide
CID 110489395
6-amino-N,N-diethyl-2-methylquinoline-4-carboxamide
CID 110489421
N-(2-methoxyethyl)-6-methyl-2-phenylquinoline-4-carboxamide
CID 4795719
N-(1-methoxypropan-2-yl)-2,6-dimethylquinoline-4-carboxamide
CID 18160978
methyl 6-[(2,6-dimethylquinoline-4-carbonyl)amino]hexanoate
CID 31838218
N-(2-benzamidoethyl)-2-methylquinoline-4-carboxamide
CID 38202874
7-acetamido-N-(2-methoxyethyl)-2-methylquinoline-5-carboxamide
CID 50842476
2-hydrazinyl-N-(2-methoxyethyl)quinoline-4-carboxamide
CID 62235922
ethyl 7-[(2,6-dimethylquinoline-4-carbonyl)amino]heptanoate
CID 60521634
2-amino-N-[2-(2-methoxyethoxy)ethyl]quinoline-4-carboxamide
CID 62160032
N-(2-aminoethyl)-7-methoxy-2-methylquinoline-4-carboxamide
CID 119061251

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(2-methoxyethyl)-2-methylquinoline-4-carboxamide?
The IUPAC name of 6-amino-N-(2-methoxyethyl)-2-methylquinoline-4-carboxamide (CID 110489408) is 6-amino-N-(2-methoxyethyl)-2-methylquinoline-4-carboxamide.
What is the SMILES notation for 6-amino-N-(2-methoxyethyl)-2-methylquinoline-4-carboxamide?
The canonical SMILES for 6-amino-N-(2-methoxyethyl)-2-methylquinoline-4-carboxamide is COCCNC(=O)c1cc(C)nc2ccc(N)cc12.
What is the InChIKey of 6-amino-N-(2-methoxyethyl)-2-methylquinoline-4-carboxamide?
The InChIKey is OYAIAUCYYKMKTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-9-7-12(14(18)16-5-6-19-2)11-8-10(15)3-4-13(11)17-9/h3-4,7-8H,5-6,15H2,1-2H3,(H,16,18).
What are the key properties of 6-amino-N-(2-methoxyethyl)-2-methylquinoline-4-carboxamide?
6-amino-N-(2-methoxyethyl)-2-methylquinoline-4-carboxamide has a molecular weight of 259.31 g/mol, XLogP of 1.50, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(2-methoxyethyl)-2-methylquinoline-4-carboxamide is sourced from PubChem (CID 110489408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).