7-amino-8-(3-hydroxy-2-methylphenyl)quinoline-6-carboxamide

C17H15N3O2 — CID 171645303

IUPAC7-amino-8-(3-hydroxy-2-methylphenyl)quinoline-6-carboxamide
SMILESCc1c(O)cccc1-c1c(N)c(C(N)=O)cc2cccnc12
InChIInChI=1S/C17H15N3O2/c1-9-11(5-2-6-13(9)21)14-15(18)12(17(19)22)8-10-4-3-7-20-16(10)14/h2-8,21H,18H2,1H3,(H2,19,22)
InChIKeyHRSDUSTVSDZKOM-UHFFFAOYSA-N
MW293.33 g/mol
LogP2.60
Rot. Bonds2

About 7-amino-8-(3-hydroxy-2-methylphenyl)quinoline-6-carboxamide

7-amino-8-(3-hydroxy-2-methylphenyl)quinoline-6-carboxamide (PubChem CID 171645303) has the molecular formula C17H15N3O2 and a molecular weight of 293.33 g/mol. Its IUPAC name is 7-amino-8-(3-hydroxy-2-methylphenyl)quinoline-6-carboxamide.

Molecular Properties

Compound Name7-amino-8-(3-hydroxy-2-methylphenyl)quinoline-6-carboxamide
PubChem CID171645303
Molecular FormulaC17H15N3O2
Molecular Weight293.33 g/mol
Exact Mass293.12
IUPAC Name7-amino-8-(3-hydroxy-2-methylphenyl)quinoline-6-carboxamide
SMILESCc1c(O)cccc1-c1c(N)c(C(N)=O)cc2cccnc12
InChIInChI=1S/C17H15N3O2/c1-9-11(5-2-6-13(9)21)14-15(18)12(17(19)22)8-10-4-3-7-20-16(10)14/h2-8,21H,18H2,1H3,(H2,19,22)
InChIKeyHRSDUSTVSDZKOM-UHFFFAOYSA-N
XLogP2.60
TPSA102.23 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 52.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-amino-5-(3-hydroxy-2-methylphenyl)quinoline-7-carboxamide
CID 171645198
8-(3-hydroxy-2-methylphenyl)quinoxaline-6-carboxamide
CID 171645149
2-methylbenzamide;quinolin-8-amine
CID 174903342
carbamoperoxoic acid;quinolin-8-ol
CID 175492056
5-amino-1-ethyl-4-(3-hydroxy-2-methylphenyl)pyrrolo[2,3-b]pyridine-3,6-dicarboxamide
CID 171820275
1-(2-methyl-1,10-phenanthrolin-3-yl)ethanone
CID 11593871
8-hydroxy-5-methylquinoline-7-carboxamide
CID 21271433
6-methylquinoline-7-carboxamide
CID 142343744
7-methyl-8-(4-methylsulfanylphenyl)quinoline-6-carboxylic acid
CID 118950405
5-amino-4-(3-hydroxy-2-methylphenyl)-1,3-dimethylpyrazolo[3,4-b]pyridine-6-carboxamide;formamide
CID 171820136
2-hydroxy-3-(2-methyl-4-pyridinyl)benzamide
CID 151221470
acetic acid;bis(palladium);bis(quinolin-8-ol)
CID 171726767

Frequently Asked Questions

What is the IUPAC name of 7-amino-8-(3-hydroxy-2-methylphenyl)quinoline-6-carboxamide?
The IUPAC name of 7-amino-8-(3-hydroxy-2-methylphenyl)quinoline-6-carboxamide (CID 171645303) is 7-amino-8-(3-hydroxy-2-methylphenyl)quinoline-6-carboxamide.
What is the SMILES notation for 7-amino-8-(3-hydroxy-2-methylphenyl)quinoline-6-carboxamide?
The canonical SMILES for 7-amino-8-(3-hydroxy-2-methylphenyl)quinoline-6-carboxamide is Cc1c(O)cccc1-c1c(N)c(C(N)=O)cc2cccnc12.
What is the InChIKey of 7-amino-8-(3-hydroxy-2-methylphenyl)quinoline-6-carboxamide?
The InChIKey is HRSDUSTVSDZKOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2/c1-9-11(5-2-6-13(9)21)14-15(18)12(17(19)22)8-10-4-3-7-20-16(10)14/h2-8,21H,18H2,1H3,(H2,19,22).
What are the key properties of 7-amino-8-(3-hydroxy-2-methylphenyl)quinoline-6-carboxamide?
7-amino-8-(3-hydroxy-2-methylphenyl)quinoline-6-carboxamide has a molecular weight of 293.33 g/mol, XLogP of 2.60, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-8-(3-hydroxy-2-methylphenyl)quinoline-6-carboxamide is sourced from PubChem (CID 171645303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).