7-[amino(pyridin-3-yl)methyl]-5-methylquinolin-8-ol

C16H15N3O — CID 164865697

IUPAC7-[amino(pyridin-3-yl)methyl]-5-methylquinolin-8-ol
SMILESCc1cc(C(N)c2cccnc2)c(O)c2ncccc12
InChIInChI=1S/C16H15N3O/c1-10-8-13(14(17)11-4-2-6-18-9-11)16(20)15-12(10)5-3-7-19-15/h2-9,14,20H,17H2,1H3
InChIKeyPYPOUXGMQVOIPQ-UHFFFAOYSA-N
MW265.32 g/mol
LogP2.69
Rot. Bonds2

About 7-[amino(pyridin-3-yl)methyl]-5-methylquinolin-8-ol

7-[amino(pyridin-3-yl)methyl]-5-methylquinolin-8-ol (PubChem CID 164865697) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is 7-[amino(pyridin-3-yl)methyl]-5-methylquinolin-8-ol.

Molecular Properties

Compound Name7-[amino(pyridin-3-yl)methyl]-5-methylquinolin-8-ol
PubChem CID164865697
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC Name7-[amino(pyridin-3-yl)methyl]-5-methylquinolin-8-ol
SMILESCc1cc(C(N)c2cccnc2)c(O)c2ncccc12
InChIInChI=1S/C16H15N3O/c1-10-8-13(14(17)11-4-2-6-18-9-11)16(20)15-12(10)5-3-7-19-15/h2-9,14,20H,17H2,1H3
InChIKeyPYPOUXGMQVOIPQ-UHFFFAOYSA-N
XLogP2.69
TPSA72.03 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

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Related Compounds

N-[(8-hydroxy-5-methylquinolin-7-yl)-pyridin-3-ylmethyl]butanamide
CID 164865676
2-[(8-hydroxy-5-methylquinolin-7-yl)-pyridin-3-ylmethyl]hexanamide
CID 175779724
4-amino-N-[(8-hydroxy-5-methylquinolin-7-yl)-pyridin-3-ylmethyl]butanamide
CID 171433993
5,7-dimethylquinolin-8-ol
CID 118341298
5-chloro-7-[hydroxy(pyridin-3-yl)methyl]quinolin-8-ol
CID 146026296
5-methyl-7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol
CID 147199836
7-fluoro-5-methylquinolin-8-ol
CID 59613713
8-hydroxy-5-methylquinoline-7-carboxamide
CID 21271433
(2-bromo-4-methylphenyl)-pyridin-3-ylmethanamine
CID 115799755
1-[(5-chloro-8-hydroxyquinolin-7-yl)-pyridin-3-ylmethyl]cyclopropane-1-carboxamide
CID 175779749
(2-methylpyrimidin-4-yl)-pyridin-3-ylmethanamine
CID 115530395
7-[(R)-[(4-methyl-2-pyridinyl)amino]-pyridin-3-ylmethyl]quinolin-8-ol
CID 703326

Frequently Asked Questions

What is the IUPAC name of 7-[amino(pyridin-3-yl)methyl]-5-methylquinolin-8-ol?
The IUPAC name of 7-[amino(pyridin-3-yl)methyl]-5-methylquinolin-8-ol (CID 164865697) is 7-[amino(pyridin-3-yl)methyl]-5-methylquinolin-8-ol.
What is the SMILES notation for 7-[amino(pyridin-3-yl)methyl]-5-methylquinolin-8-ol?
The canonical SMILES for 7-[amino(pyridin-3-yl)methyl]-5-methylquinolin-8-ol is Cc1cc(C(N)c2cccnc2)c(O)c2ncccc12.
What is the InChIKey of 7-[amino(pyridin-3-yl)methyl]-5-methylquinolin-8-ol?
The InChIKey is PYPOUXGMQVOIPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c1-10-8-13(14(17)11-4-2-6-18-9-11)16(20)15-12(10)5-3-7-19-15/h2-9,14,20H,17H2,1H3.
What are the key properties of 7-[amino(pyridin-3-yl)methyl]-5-methylquinolin-8-ol?
7-[amino(pyridin-3-yl)methyl]-5-methylquinolin-8-ol has a molecular weight of 265.32 g/mol, XLogP of 2.69, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[amino(pyridin-3-yl)methyl]-5-methylquinolin-8-ol is sourced from PubChem (CID 164865697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).