2-methoxy-N-[3-[(pyridin-2-ylmethylamino)methyl]phenyl]acetamide

C16H19N3O2 — CID 47025423

IUPAC2-methoxy-N-[3-[(pyridin-2-ylmethylamino)methyl]phenyl]acetamide
SMILESCOCC(=O)Nc1cccc(CNCc2ccccn2)c1
InChIInChI=1S/C16H19N3O2/c1-21-12-16(20)19-14-7-4-5-13(9-14)10-17-11-15-6-2-3-8-18-15/h2-9,17H,10-12H2,1H3,(H,19,20)
InChIKeyIPHNYKWZCJYQBP-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.96
Rot. Bonds7

About 2-methoxy-N-[3-[(pyridin-2-ylmethylamino)methyl]phenyl]acetamide

2-methoxy-N-[3-[(pyridin-2-ylmethylamino)methyl]phenyl]acetamide (PubChem CID 47025423) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 2-methoxy-N-[3-[(pyridin-2-ylmethylamino)methyl]phenyl]acetamide.

Molecular Properties

Compound Name2-methoxy-N-[3-[(pyridin-2-ylmethylamino)methyl]phenyl]acetamide
PubChem CID47025423
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name2-methoxy-N-[3-[(pyridin-2-ylmethylamino)methyl]phenyl]acetamide
SMILESCOCC(=O)Nc1cccc(CNCc2ccccn2)c1
InChIInChI=1S/C16H19N3O2/c1-21-12-16(20)19-14-7-4-5-13(9-14)10-17-11-15-6-2-3-8-18-15/h2-9,17H,10-12H2,1H3,(H,19,20)
InChIKeyIPHNYKWZCJYQBP-UHFFFAOYSA-N
XLogP1.96
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(ethylaminomethyl)phenyl]-2-(pyridin-2-ylmethylsulfanyl)acetamide
CID 119438197
2-methoxy-N-[3-(pyrimidin-4-ylmethylamino)phenyl]acetamide
CID 62748713
N-[3-(pyridin-2-ylmethylamino)phenyl]propanamide
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N-[3-[(3-bromophenyl)methylamino]phenyl]-2-methoxyacetamide
CID 43713051
N-(3,4-dimethoxyphenyl)-3-(pyridin-2-ylmethylamino)propanamide
CID 109023408
N-[3-[[[N'-methyl-N-(pyridin-2-ylmethyl)carbamimidoyl]amino]methyl]phenyl]acetamide;hydroiodide
CID 110970438
1-(3-chlorophenyl)-N-(pyridin-2-ylmethyl)methanamine
CID 4719779
1-[4-(methoxymethyl)phenyl]-N-(pyridin-2-ylmethyl)methanamine
CID 60751892
N-(3-acetamidophenyl)-2-pyridin-2-ylacetamide
CID 110697004
2-methoxy-N-(4-pyridin-2-ylphenyl)acetamide
CID 110460506
ethane;2-methoxy-N-phenylacetamide;yttrium
CID 159976159
N-[3-[[[methyl(pyridin-2-ylmethyl)carbamoyl]amino]methyl]phenyl]-2-pyrazol-1-ylacetamide
CID 86841993

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[3-[(pyridin-2-ylmethylamino)methyl]phenyl]acetamide?
The IUPAC name of 2-methoxy-N-[3-[(pyridin-2-ylmethylamino)methyl]phenyl]acetamide (CID 47025423) is 2-methoxy-N-[3-[(pyridin-2-ylmethylamino)methyl]phenyl]acetamide.
What is the SMILES notation for 2-methoxy-N-[3-[(pyridin-2-ylmethylamino)methyl]phenyl]acetamide?
The canonical SMILES for 2-methoxy-N-[3-[(pyridin-2-ylmethylamino)methyl]phenyl]acetamide is COCC(=O)Nc1cccc(CNCc2ccccn2)c1.
What is the InChIKey of 2-methoxy-N-[3-[(pyridin-2-ylmethylamino)methyl]phenyl]acetamide?
The InChIKey is IPHNYKWZCJYQBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-21-12-16(20)19-14-7-4-5-13(9-14)10-17-11-15-6-2-3-8-18-15/h2-9,17H,10-12H2,1H3,(H,19,20).
What are the key properties of 2-methoxy-N-[3-[(pyridin-2-ylmethylamino)methyl]phenyl]acetamide?
2-methoxy-N-[3-[(pyridin-2-ylmethylamino)methyl]phenyl]acetamide has a molecular weight of 285.35 g/mol, XLogP of 1.96, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[3-[(pyridin-2-ylmethylamino)methyl]phenyl]acetamide is sourced from PubChem (CID 47025423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).