N-methyl-1-(2-methyl-3-pyridinyl)-2-quinolin-2-ylethanamine

C18H19N3 — CID 105159170

IUPACN-methyl-1-(2-methyl-3-pyridinyl)-2-quinolin-2-ylethanamine
SMILESCNC(Cc1ccc2ccccc2n1)c1cccnc1C
InChIInChI=1S/C18H19N3/c1-13-16(7-5-11-20-13)18(19-2)12-15-10-9-14-6-3-4-8-17(14)21-15/h3-11,18-19H,12H2,1-2H3
InChIKeyXZGPDTINWVLGTH-UHFFFAOYSA-N
MW277.37 g/mol
LogP3.44
Rot. Bonds4

About N-methyl-1-(2-methyl-3-pyridinyl)-2-quinolin-2-ylethanamine

N-methyl-1-(2-methyl-3-pyridinyl)-2-quinolin-2-ylethanamine (PubChem CID 105159170) has the molecular formula C18H19N3 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-methyl-1-(2-methyl-3-pyridinyl)-2-quinolin-2-ylethanamine.

Molecular Properties

Compound NameN-methyl-1-(2-methyl-3-pyridinyl)-2-quinolin-2-ylethanamine
PubChem CID105159170
Molecular FormulaC18H19N3
Molecular Weight277.37 g/mol
Exact Mass277.16
IUPAC NameN-methyl-1-(2-methyl-3-pyridinyl)-2-quinolin-2-ylethanamine
SMILESCNC(Cc1ccc2ccccc2n1)c1cccnc1C
InChIInChI=1S/C18H19N3/c1-13-16(7-5-11-20-13)18(19-2)12-15-10-9-14-6-3-4-8-17(14)21-15/h3-11,18-19H,12H2,1-2H3
InChIKeyXZGPDTINWVLGTH-UHFFFAOYSA-N
XLogP3.44
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-methyl-3-pyridinyl)-2-quinolin-2-ylethanamine?
The IUPAC name of N-methyl-1-(2-methyl-3-pyridinyl)-2-quinolin-2-ylethanamine (CID 105159170) is N-methyl-1-(2-methyl-3-pyridinyl)-2-quinolin-2-ylethanamine.
What is the SMILES notation for N-methyl-1-(2-methyl-3-pyridinyl)-2-quinolin-2-ylethanamine?
The canonical SMILES for N-methyl-1-(2-methyl-3-pyridinyl)-2-quinolin-2-ylethanamine is CNC(Cc1ccc2ccccc2n1)c1cccnc1C.
What is the InChIKey of N-methyl-1-(2-methyl-3-pyridinyl)-2-quinolin-2-ylethanamine?
The InChIKey is XZGPDTINWVLGTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3/c1-13-16(7-5-11-20-13)18(19-2)12-15-10-9-14-6-3-4-8-17(14)21-15/h3-11,18-19H,12H2,1-2H3.
What are the key properties of N-methyl-1-(2-methyl-3-pyridinyl)-2-quinolin-2-ylethanamine?
N-methyl-1-(2-methyl-3-pyridinyl)-2-quinolin-2-ylethanamine has a molecular weight of 277.37 g/mol, XLogP of 3.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-methyl-3-pyridinyl)-2-quinolin-2-ylethanamine is sourced from PubChem (CID 105159170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).