N-methyl-1-[6-methyl-3-(2-pyridin-2-ylethoxy)-2-pyridinyl]methanamine

C15H19N3O — CID 79151107

IUPACN-methyl-1-[6-methyl-3-(2-pyridin-2-ylethoxy)-2-pyridinyl]methanamine
SMILESCNCc1nc(C)ccc1OCCc1ccccn1
InChIInChI=1S/C15H19N3O/c1-12-6-7-15(14(18-12)11-16-2)19-10-8-13-5-3-4-9-17-13/h3-7,9,16H,8,10-11H2,1-2H3
InChIKeyYECNZXJBXKFAMY-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.13
Rot. Bonds6

About N-methyl-1-[6-methyl-3-(2-pyridin-2-ylethoxy)-2-pyridinyl]methanamine

N-methyl-1-[6-methyl-3-(2-pyridin-2-ylethoxy)-2-pyridinyl]methanamine (PubChem CID 79151107) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is N-methyl-1-[6-methyl-3-(2-pyridin-2-ylethoxy)-2-pyridinyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[6-methyl-3-(2-pyridin-2-ylethoxy)-2-pyridinyl]methanamine
PubChem CID79151107
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC NameN-methyl-1-[6-methyl-3-(2-pyridin-2-ylethoxy)-2-pyridinyl]methanamine
SMILESCNCc1nc(C)ccc1OCCc1ccccn1
InChIInChI=1S/C15H19N3O/c1-12-6-7-15(14(18-12)11-16-2)19-10-8-13-5-3-4-9-17-13/h3-7,9,16H,8,10-11H2,1-2H3
InChIKeyYECNZXJBXKFAMY-UHFFFAOYSA-N
XLogP2.13
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[6-methyl-3-(2-pyridin-2-ylethoxy)-2-pyridinyl]methanamine?
The IUPAC name of N-methyl-1-[6-methyl-3-(2-pyridin-2-ylethoxy)-2-pyridinyl]methanamine (CID 79151107) is N-methyl-1-[6-methyl-3-(2-pyridin-2-ylethoxy)-2-pyridinyl]methanamine.
What is the SMILES notation for N-methyl-1-[6-methyl-3-(2-pyridin-2-ylethoxy)-2-pyridinyl]methanamine?
The canonical SMILES for N-methyl-1-[6-methyl-3-(2-pyridin-2-ylethoxy)-2-pyridinyl]methanamine is CNCc1nc(C)ccc1OCCc1ccccn1.
What is the InChIKey of N-methyl-1-[6-methyl-3-(2-pyridin-2-ylethoxy)-2-pyridinyl]methanamine?
The InChIKey is YECNZXJBXKFAMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-12-6-7-15(14(18-12)11-16-2)19-10-8-13-5-3-4-9-17-13/h3-7,9,16H,8,10-11H2,1-2H3.
What are the key properties of N-methyl-1-[6-methyl-3-(2-pyridin-2-ylethoxy)-2-pyridinyl]methanamine?
N-methyl-1-[6-methyl-3-(2-pyridin-2-ylethoxy)-2-pyridinyl]methanamine has a molecular weight of 257.34 g/mol, XLogP of 2.13, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[6-methyl-3-(2-pyridin-2-ylethoxy)-2-pyridinyl]methanamine is sourced from PubChem (CID 79151107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).