N-[(6-methoxy-3-pyridinyl)methyl]-1-pyridin-2-ylethanamine

C14H17N3O — CID 43206290

IUPACN-[(6-methoxy-3-pyridinyl)methyl]-1-pyridin-2-ylethanamine
SMILESCOc1ccc(CNC(C)c2ccccn2)cn1
InChIInChI=1S/C14H17N3O/c1-11(13-5-3-4-8-15-13)16-9-12-6-7-14(18-2)17-10-12/h3-8,10-11,16H,9H2,1-2H3
InChIKeyZEOQVRKNQXMWLO-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.34
Rot. Bonds5

About N-[(6-methoxy-3-pyridinyl)methyl]-1-pyridin-2-ylethanamine

N-[(6-methoxy-3-pyridinyl)methyl]-1-pyridin-2-ylethanamine (PubChem CID 43206290) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is N-[(6-methoxy-3-pyridinyl)methyl]-1-pyridin-2-ylethanamine.

Molecular Properties

Compound NameN-[(6-methoxy-3-pyridinyl)methyl]-1-pyridin-2-ylethanamine
PubChem CID43206290
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC NameN-[(6-methoxy-3-pyridinyl)methyl]-1-pyridin-2-ylethanamine
SMILESCOc1ccc(CNC(C)c2ccccn2)cn1
InChIInChI=1S/C14H17N3O/c1-11(13-5-3-4-8-15-13)16-9-12-6-7-14(18-2)17-10-12/h3-8,10-11,16H,9H2,1-2H3
InChIKeyZEOQVRKNQXMWLO-UHFFFAOYSA-N
XLogP2.34
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1R)-N-[(6-methoxy-3-pyridinyl)methyl]-1-phenylethanamine
CID 28712228
(1S)-N-[(6-methoxy-3-pyridinyl)methyl]-1-phenylethanamine
CID 28712225
(1S)-N-[(6-methoxy-3-pyridinyl)methyl]-1-pyridin-3-ylethanamine
CID 28712310
1-pyridin-2-yl-N-[(3,4,5-trimethoxyphenyl)methyl]ethanamine
CID 47008253
N-[(6-methoxy-3-pyridinyl)methyl]-1-(5-methylfuran-2-yl)ethanamine
CID 43206302
N-[(6-methoxy-3-pyridinyl)methyl]-1-thiophen-2-ylethanamine
CID 43206293
(1R)-1-pyridin-2-yl-N-(pyrimidin-5-ylmethyl)ethanamine
CID 81402120
(1S)-N-[(3-fluoro-4-methoxyphenyl)methyl]-1-pyridin-2-ylethanamine
CID 78978043
(1R)-N-[(3-fluoro-4-methoxyphenyl)methyl]-1-pyridin-2-ylethanamine
CID 81402354
(1S)-1-pyridin-2-yl-N-[(4-trimethylsilylphenyl)methyl]ethanamine
CID 103437978
1-(4-iodophenyl)-N-[(6-methoxy-3-pyridinyl)methyl]ethanamine
CID 43770459
(1R)-1-(3-methoxyphenyl)-N-[(6-methoxy-3-pyridinyl)methyl]ethanamine
CID 28712390

Frequently Asked Questions

What is the IUPAC name of N-[(6-methoxy-3-pyridinyl)methyl]-1-pyridin-2-ylethanamine?
The IUPAC name of N-[(6-methoxy-3-pyridinyl)methyl]-1-pyridin-2-ylethanamine (CID 43206290) is N-[(6-methoxy-3-pyridinyl)methyl]-1-pyridin-2-ylethanamine.
What is the SMILES notation for N-[(6-methoxy-3-pyridinyl)methyl]-1-pyridin-2-ylethanamine?
The canonical SMILES for N-[(6-methoxy-3-pyridinyl)methyl]-1-pyridin-2-ylethanamine is COc1ccc(CNC(C)c2ccccn2)cn1.
What is the InChIKey of N-[(6-methoxy-3-pyridinyl)methyl]-1-pyridin-2-ylethanamine?
The InChIKey is ZEOQVRKNQXMWLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c1-11(13-5-3-4-8-15-13)16-9-12-6-7-14(18-2)17-10-12/h3-8,10-11,16H,9H2,1-2H3.
What are the key properties of N-[(6-methoxy-3-pyridinyl)methyl]-1-pyridin-2-ylethanamine?
N-[(6-methoxy-3-pyridinyl)methyl]-1-pyridin-2-ylethanamine has a molecular weight of 243.31 g/mol, XLogP of 2.34, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-methoxy-3-pyridinyl)methyl]-1-pyridin-2-ylethanamine is sourced from PubChem (CID 43206290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).