N-(3-aminoquinolin-6-yl)-2-hydroxy-5-methoxybenzamide

C17H15N3O3 — CID 175430915

IUPACN-(3-aminoquinolin-6-yl)-2-hydroxy-5-methoxybenzamide
SMILESCOc1ccc(O)c(C(=O)Nc2ccc3ncc(N)cc3c2)c1
InChIInChI=1S/C17H15N3O3/c1-23-13-3-5-16(21)14(8-13)17(22)20-12-2-4-15-10(7-12)6-11(18)9-19-15/h2-9,21H,18H2,1H3,(H,20,22)
InChIKeyXLNDULIFWSPQFF-UHFFFAOYSA-N
MW309.33 g/mol
LogP2.78
Rot. Bonds3

About N-(3-aminoquinolin-6-yl)-2-hydroxy-5-methoxybenzamide

N-(3-aminoquinolin-6-yl)-2-hydroxy-5-methoxybenzamide (PubChem CID 175430915) has the molecular formula C17H15N3O3 and a molecular weight of 309.33 g/mol. Its IUPAC name is N-(3-aminoquinolin-6-yl)-2-hydroxy-5-methoxybenzamide.

Molecular Properties

Compound NameN-(3-aminoquinolin-6-yl)-2-hydroxy-5-methoxybenzamide
PubChem CID175430915
Molecular FormulaC17H15N3O3
Molecular Weight309.33 g/mol
Exact Mass309.11
IUPAC NameN-(3-aminoquinolin-6-yl)-2-hydroxy-5-methoxybenzamide
SMILESCOc1ccc(O)c(C(=O)Nc2ccc3ncc(N)cc3c2)c1
InChIInChI=1S/C17H15N3O3/c1-23-13-3-5-16(21)14(8-13)17(22)20-12-2-4-15-10(7-12)6-11(18)9-19-15/h2-9,21H,18H2,1H3,(H,20,22)
InChIKeyXLNDULIFWSPQFF-UHFFFAOYSA-N
XLogP2.78
TPSA97.47 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.33
LogP ≤ 52.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-amino-4-bromophenyl)-2-hydroxy-5-methoxybenzamide
CID 79768277
4-[(2-hydroxy-5-methoxybenzoyl)amino]pyridine-2-carboxylic acid
CID 63650620
N-(4-formylphenyl)-2-hydroxy-5-methoxybenzamide
CID 106912375
N-(4-ethylphenyl)-2-hydroxy-5-methoxybenzamide
CID 60716192
2-amino-N-(3-chloro-4-hydroxyphenyl)-5-methoxybenzamide
CID 107679870
2-amino-N-(3-fluoro-4-hydroxyphenyl)-5-methoxybenzamide
CID 115413371
(6-methoxyquinolin-3-yl)carbamic acid
CID 22326813
5-bromo-2-hydroxy-N-(4-methoxyphenyl)benzamide
CID 14963005
2-amino-N-(3-hydroxy-4-methoxyphenyl)-5-methoxybenzamide
CID 115412684
2-hydroxy-5-methoxy-N-(4-methyl-1H-pyrazol-5-yl)benzamide
CID 112691144
2-hydroxy-5-methoxy-N-(4-nitrophenyl)benzamide
CID 10968180
2-hydroxy-N-[4-[(2-hydroxy-4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide
CID 23249025

Frequently Asked Questions

What is the IUPAC name of N-(3-aminoquinolin-6-yl)-2-hydroxy-5-methoxybenzamide?
The IUPAC name of N-(3-aminoquinolin-6-yl)-2-hydroxy-5-methoxybenzamide (CID 175430915) is N-(3-aminoquinolin-6-yl)-2-hydroxy-5-methoxybenzamide.
What is the SMILES notation for N-(3-aminoquinolin-6-yl)-2-hydroxy-5-methoxybenzamide?
The canonical SMILES for N-(3-aminoquinolin-6-yl)-2-hydroxy-5-methoxybenzamide is COc1ccc(O)c(C(=O)Nc2ccc3ncc(N)cc3c2)c1.
What is the InChIKey of N-(3-aminoquinolin-6-yl)-2-hydroxy-5-methoxybenzamide?
The InChIKey is XLNDULIFWSPQFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O3/c1-23-13-3-5-16(21)14(8-13)17(22)20-12-2-4-15-10(7-12)6-11(18)9-19-15/h2-9,21H,18H2,1H3,(H,20,22).
What are the key properties of N-(3-aminoquinolin-6-yl)-2-hydroxy-5-methoxybenzamide?
N-(3-aminoquinolin-6-yl)-2-hydroxy-5-methoxybenzamide has a molecular weight of 309.33 g/mol, XLogP of 2.78, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminoquinolin-6-yl)-2-hydroxy-5-methoxybenzamide is sourced from PubChem (CID 175430915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).