2-amino-7-ethoxy-6-methoxyquinoline-3-carboxamide

C13H15N3O3 — CID 124804844

IUPAC2-amino-7-ethoxy-6-methoxyquinoline-3-carboxamide
SMILESCCOc1cc2nc(N)c(C(N)=O)cc2cc1OC
InChIInChI=1S/C13H15N3O3/c1-3-19-11-6-9-7(5-10(11)18-2)4-8(13(15)17)12(14)16-9/h4-6H,3H2,1-2H3,(H2,14,16)(H2,15,17)
InChIKeyXDNKSPBRKVEKEV-UHFFFAOYSA-N
MW261.28 g/mol
LogP1.32
Rot. Bonds4

About 2-amino-7-ethoxy-6-methoxyquinoline-3-carboxamide

2-amino-7-ethoxy-6-methoxyquinoline-3-carboxamide (PubChem CID 124804844) has the molecular formula C13H15N3O3 and a molecular weight of 261.28 g/mol. Its IUPAC name is 2-amino-7-ethoxy-6-methoxyquinoline-3-carboxamide.

Molecular Properties

Compound Name2-amino-7-ethoxy-6-methoxyquinoline-3-carboxamide
PubChem CID124804844
Molecular FormulaC13H15N3O3
Molecular Weight261.28 g/mol
Exact Mass261.11
IUPAC Name2-amino-7-ethoxy-6-methoxyquinoline-3-carboxamide
SMILESCCOc1cc2nc(N)c(C(N)=O)cc2cc1OC
InChIInChI=1S/C13H15N3O3/c1-3-19-11-6-9-7(5-10(11)18-2)4-8(13(15)17)12(14)16-9/h4-6H,3H2,1-2H3,(H2,14,16)(H2,15,17)
InChIKeyXDNKSPBRKVEKEV-UHFFFAOYSA-N
XLogP1.32
TPSA100.46 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.28
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 2-chloro-6,7-diethoxyquinoline-3-carboxylate
CID 119054850
2-chloro-6-ethoxy-7-methoxyquinazoline
CID 141299474
methyl 2-chloro-6,7-dimethoxyquinoline-3-carboxylate
CID 119054849
2-chloro-4,5-diethoxybenzamide
CID 82268164
1,2-bis(3-ethoxy-4-methoxyphenyl)ethane-1,2-dione
CID 126457801
6,7-diethoxyquinoline-2-carboxylic acid
CID 102941445
(2-methoxyphenyl) 3-ethoxynaphthalene-2-carboxylate
CID 24505759
(6,7-diethoxy-3-ethylquinolin-2-yl)hydrazine
CID 63232958
2,4-diethoxybenzamide
CID 17145726
2-ethoxy-3,4-dimethoxybenzamide
CID 141309813
2-[4-amino-2-(hydroxymethyl)-3-methylphenyl]-7-methoxy-6-(2-morpholin-4-ylethoxy)quinoline-3-carboxamide
CID 67551519
ethyl 4-(6,7-dimethoxyquinolin-3-yl)benzoate
CID 10042684

Frequently Asked Questions

What is the IUPAC name of 2-amino-7-ethoxy-6-methoxyquinoline-3-carboxamide?
The IUPAC name of 2-amino-7-ethoxy-6-methoxyquinoline-3-carboxamide (CID 124804844) is 2-amino-7-ethoxy-6-methoxyquinoline-3-carboxamide.
What is the SMILES notation for 2-amino-7-ethoxy-6-methoxyquinoline-3-carboxamide?
The canonical SMILES for 2-amino-7-ethoxy-6-methoxyquinoline-3-carboxamide is CCOc1cc2nc(N)c(C(N)=O)cc2cc1OC.
What is the InChIKey of 2-amino-7-ethoxy-6-methoxyquinoline-3-carboxamide?
The InChIKey is XDNKSPBRKVEKEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O3/c1-3-19-11-6-9-7(5-10(11)18-2)4-8(13(15)17)12(14)16-9/h4-6H,3H2,1-2H3,(H2,14,16)(H2,15,17).
What are the key properties of 2-amino-7-ethoxy-6-methoxyquinoline-3-carboxamide?
2-amino-7-ethoxy-6-methoxyquinoline-3-carboxamide has a molecular weight of 261.28 g/mol, XLogP of 1.32, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-7-ethoxy-6-methoxyquinoline-3-carboxamide is sourced from PubChem (CID 124804844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).