N-[(2-methoxy-6-methylquinolin-3-yl)methyl]-1-pyridin-3-ylmethanamine

C18H19N3O — CID 162662034

IUPACN-[(2-methoxy-6-methylquinolin-3-yl)methyl]-1-pyridin-3-ylmethanamine
SMILESCOc1nc2ccc(C)cc2cc1CNCc1cccnc1
InChIInChI=1S/C18H19N3O/c1-13-5-6-17-15(8-13)9-16(18(21-17)22-2)12-20-11-14-4-3-7-19-10-14/h3-10,20H,11-12H2,1-2H3
InChIKeyZZGLCJAPDILJMJ-UHFFFAOYSA-N
MW293.37 g/mol
LogP3.24
Rot. Bonds5

About N-[(2-methoxy-6-methylquinolin-3-yl)methyl]-1-pyridin-3-ylmethanamine

N-[(2-methoxy-6-methylquinolin-3-yl)methyl]-1-pyridin-3-ylmethanamine (PubChem CID 162662034) has the molecular formula C18H19N3O and a molecular weight of 293.37 g/mol. Its IUPAC name is N-[(2-methoxy-6-methylquinolin-3-yl)methyl]-1-pyridin-3-ylmethanamine.

Molecular Properties

Compound NameN-[(2-methoxy-6-methylquinolin-3-yl)methyl]-1-pyridin-3-ylmethanamine
PubChem CID162662034
Molecular FormulaC18H19N3O
Molecular Weight293.37 g/mol
Exact Mass293.15
IUPAC NameN-[(2-methoxy-6-methylquinolin-3-yl)methyl]-1-pyridin-3-ylmethanamine
SMILESCOc1nc2ccc(C)cc2cc1CNCc1cccnc1
InChIInChI=1S/C18H19N3O/c1-13-5-6-17-15(8-13)9-16(18(21-17)22-2)12-20-11-14-4-3-7-19-10-14/h3-10,20H,11-12H2,1-2H3
InChIKeyZZGLCJAPDILJMJ-UHFFFAOYSA-N
XLogP3.24
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxy-6-methylquinolin-3-yl)methyl]-1-pyridin-3-ylmethanamine?
The IUPAC name of N-[(2-methoxy-6-methylquinolin-3-yl)methyl]-1-pyridin-3-ylmethanamine (CID 162662034) is N-[(2-methoxy-6-methylquinolin-3-yl)methyl]-1-pyridin-3-ylmethanamine.
What is the SMILES notation for N-[(2-methoxy-6-methylquinolin-3-yl)methyl]-1-pyridin-3-ylmethanamine?
The canonical SMILES for N-[(2-methoxy-6-methylquinolin-3-yl)methyl]-1-pyridin-3-ylmethanamine is COc1nc2ccc(C)cc2cc1CNCc1cccnc1.
What is the InChIKey of N-[(2-methoxy-6-methylquinolin-3-yl)methyl]-1-pyridin-3-ylmethanamine?
The InChIKey is ZZGLCJAPDILJMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O/c1-13-5-6-17-15(8-13)9-16(18(21-17)22-2)12-20-11-14-4-3-7-19-10-14/h3-10,20H,11-12H2,1-2H3.
What are the key properties of N-[(2-methoxy-6-methylquinolin-3-yl)methyl]-1-pyridin-3-ylmethanamine?
N-[(2-methoxy-6-methylquinolin-3-yl)methyl]-1-pyridin-3-ylmethanamine has a molecular weight of 293.37 g/mol, XLogP of 3.24, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxy-6-methylquinolin-3-yl)methyl]-1-pyridin-3-ylmethanamine is sourced from PubChem (CID 162662034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).