2-amino-N-ethyl-N-methylquinoline-4-carboxamide

C13H15N3O — CID 62154590

IUPAC2-amino-N-ethyl-N-methylquinoline-4-carboxamide
SMILESCCN(C)C(=O)c1cc(N)nc2ccccc12
InChIInChI=1S/C13H15N3O/c1-3-16(2)13(17)10-8-12(14)15-11-7-5-4-6-9(10)11/h4-8H,3H2,1-2H3,(H2,14,15)
InChIKeyZLNYTTBETCIPIK-UHFFFAOYSA-N
MW229.28 g/mol
LogP1.91
Rot. Bonds2

About 2-amino-N-ethyl-N-methylquinoline-4-carboxamide

2-amino-N-ethyl-N-methylquinoline-4-carboxamide (PubChem CID 62154590) has the molecular formula C13H15N3O and a molecular weight of 229.28 g/mol. Its IUPAC name is 2-amino-N-ethyl-N-methylquinoline-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-ethyl-N-methylquinoline-4-carboxamide
PubChem CID62154590
Molecular FormulaC13H15N3O
Molecular Weight229.28 g/mol
Exact Mass229.12
IUPAC Name2-amino-N-ethyl-N-methylquinoline-4-carboxamide
SMILESCCN(C)C(=O)c1cc(N)nc2ccccc12
InChIInChI=1S/C13H15N3O/c1-3-16(2)13(17)10-8-12(14)15-11-7-5-4-6-9(10)11/h4-8H,3H2,1-2H3,(H2,14,15)
InChIKeyZLNYTTBETCIPIK-UHFFFAOYSA-N
XLogP1.91
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N,N-diethylquinoline-4-carboxamide
CID 62155871
2-amino-N-[2-(dimethylamino)ethyl]-N-methylquinoline-4-carboxamide
CID 63727745
2-amino-N-methyl-N-(3-methylbutyl)quinoline-4-carboxamide
CID 62185839
2-amino-N-ethyl-N-propan-2-ylquinoline-4-carboxamide
CID 62154240
2-amino-N-butan-2-yl-N-methylquinoline-4-carboxamide
CID 62154754
2-amino-N-methyl-N-phenylquinoline-4-carboxamide
CID 62155545
2-amino-N-methyl-N-(2-methylbutan-2-yl)quinoline-4-carboxamide
CID 63961651
2-amino-N-methyl-N-(1H-1,2,4-triazol-5-ylmethyl)quinoline-4-carboxamide
CID 64518344
2-amino-N-cyclopropyl-N-methylquinoline-4-carboxamide
CID 62156130
2-amino-N-(3,3-dimethylbutan-2-yl)-N-methylquinoline-4-carboxamide
CID 62160861
2-amino-N-[2-[methyl(propan-2-yl)amino]ethyl]quinoline-4-carboxamide
CID 62640770
2-amino-N-(2-methylsulfonylethyl)quinoline-4-carboxamide
CID 62152474

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-ethyl-N-methylquinoline-4-carboxamide?
The IUPAC name of 2-amino-N-ethyl-N-methylquinoline-4-carboxamide (CID 62154590) is 2-amino-N-ethyl-N-methylquinoline-4-carboxamide.
What is the SMILES notation for 2-amino-N-ethyl-N-methylquinoline-4-carboxamide?
The canonical SMILES for 2-amino-N-ethyl-N-methylquinoline-4-carboxamide is CCN(C)C(=O)c1cc(N)nc2ccccc12.
What is the InChIKey of 2-amino-N-ethyl-N-methylquinoline-4-carboxamide?
The InChIKey is ZLNYTTBETCIPIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O/c1-3-16(2)13(17)10-8-12(14)15-11-7-5-4-6-9(10)11/h4-8H,3H2,1-2H3,(H2,14,15).
What are the key properties of 2-amino-N-ethyl-N-methylquinoline-4-carboxamide?
2-amino-N-ethyl-N-methylquinoline-4-carboxamide has a molecular weight of 229.28 g/mol, XLogP of 1.91, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-ethyl-N-methylquinoline-4-carboxamide is sourced from PubChem (CID 62154590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).