2-[(8-hydroxy-5-methylquinolin-7-yl)-pyridin-3-ylmethyl]hexanamide

C22H25N3O2 — CID 175779724

IUPAC2-[(8-hydroxy-5-methylquinolin-7-yl)-pyridin-3-ylmethyl]hexanamide
SMILESCCCCC(C(N)=O)C(c1cccnc1)c1cc(C)c2cccnc2c1O
InChIInChI=1S/C22H25N3O2/c1-3-4-8-17(22(23)27)19(15-7-5-10-24-13-15)18-12-14(2)16-9-6-11-25-20(16)21(18)26/h5-7,9-13,17,19,26H,3-4,8H2,1-2H3,(H2,23,27)
InChIKeyQOWDTHPKQXFRIY-UHFFFAOYSA-N
MW363.46 g/mol
LogP4.07
Rot. Bonds7

About 2-[(8-hydroxy-5-methylquinolin-7-yl)-pyridin-3-ylmethyl]hexanamide

2-[(8-hydroxy-5-methylquinolin-7-yl)-pyridin-3-ylmethyl]hexanamide (PubChem CID 175779724) has the molecular formula C22H25N3O2 and a molecular weight of 363.46 g/mol. Its IUPAC name is 2-[(8-hydroxy-5-methylquinolin-7-yl)-pyridin-3-ylmethyl]hexanamide.

Molecular Properties

Compound Name2-[(8-hydroxy-5-methylquinolin-7-yl)-pyridin-3-ylmethyl]hexanamide
PubChem CID175779724
Molecular FormulaC22H25N3O2
Molecular Weight363.46 g/mol
Exact Mass363.19
IUPAC Name2-[(8-hydroxy-5-methylquinolin-7-yl)-pyridin-3-ylmethyl]hexanamide
SMILESCCCCC(C(N)=O)C(c1cccnc1)c1cc(C)c2cccnc2c1O
InChIInChI=1S/C22H25N3O2/c1-3-4-8-17(22(23)27)19(15-7-5-10-24-13-15)18-12-14(2)16-9-6-11-25-20(16)21(18)26/h5-7,9-13,17,19,26H,3-4,8H2,1-2H3,(H2,23,27)
InChIKeyQOWDTHPKQXFRIY-UHFFFAOYSA-N
XLogP4.07
TPSA89.10 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.46
LogP ≤ 54.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

7-[amino(pyridin-3-yl)methyl]-5-methylquinolin-8-ol
CID 164865697
N-[(8-hydroxy-5-methylquinolin-7-yl)-pyridin-3-ylmethyl]butanamide
CID 164865676
4-amino-N-[(8-hydroxy-5-methylquinolin-7-yl)-pyridin-3-ylmethyl]butanamide
CID 171433993
N-[(5-acetyl-8-hydroxyquinolin-7-yl)-pyridin-3-ylmethyl]butanamide
CID 164865631
8-hydroxy-5-methylquinoline-7-carboxamide
CID 21271433
N-[(8-hydroxy-5-methylquinolin-7-yl)-(2-oxo-3H-1,3-benzoxazol-6-yl)methyl]butanamide
CID 164865668
1-[(5-chloro-8-hydroxyquinolin-7-yl)-pyridin-3-ylmethyl]cyclopropane-1-carboxamide
CID 175779749
5,7-dimethylquinolin-8-ol
CID 118341298
N-[(8-hydroxy-5-pyrrolidin-1-ylquinolin-7-yl)-pyridin-3-ylmethyl]butanamide
CID 164865667
5-chloro-7-[hydroxy(pyridin-3-yl)methyl]quinolin-8-ol
CID 146026296
2-chloro-N-[(5-chloro-8-hydroxyquinolin-7-yl)-pyridin-3-ylmethyl]acetamide
CID 164865635
3-(5-chloro-8-hydroxyquinolin-7-yl)-3-(2-chlorophenyl)-2-phenylpropanamide
CID 173159899

Frequently Asked Questions

What is the IUPAC name of 2-[(8-hydroxy-5-methylquinolin-7-yl)-pyridin-3-ylmethyl]hexanamide?
The IUPAC name of 2-[(8-hydroxy-5-methylquinolin-7-yl)-pyridin-3-ylmethyl]hexanamide (CID 175779724) is 2-[(8-hydroxy-5-methylquinolin-7-yl)-pyridin-3-ylmethyl]hexanamide.
What is the SMILES notation for 2-[(8-hydroxy-5-methylquinolin-7-yl)-pyridin-3-ylmethyl]hexanamide?
The canonical SMILES for 2-[(8-hydroxy-5-methylquinolin-7-yl)-pyridin-3-ylmethyl]hexanamide is CCCCC(C(N)=O)C(c1cccnc1)c1cc(C)c2cccnc2c1O.
What is the InChIKey of 2-[(8-hydroxy-5-methylquinolin-7-yl)-pyridin-3-ylmethyl]hexanamide?
The InChIKey is QOWDTHPKQXFRIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O2/c1-3-4-8-17(22(23)27)19(15-7-5-10-24-13-15)18-12-14(2)16-9-6-11-25-20(16)21(18)26/h5-7,9-13,17,19,26H,3-4,8H2,1-2H3,(H2,23,27).
What are the key properties of 2-[(8-hydroxy-5-methylquinolin-7-yl)-pyridin-3-ylmethyl]hexanamide?
2-[(8-hydroxy-5-methylquinolin-7-yl)-pyridin-3-ylmethyl]hexanamide has a molecular weight of 363.46 g/mol, XLogP of 4.07, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(8-hydroxy-5-methylquinolin-7-yl)-pyridin-3-ylmethyl]hexanamide is sourced from PubChem (CID 175779724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).