2-[2-(aminomethyl)phenoxy]-N-(4,6-dimethyl-2-pyridinyl)acetamide

C16H19N3O2 — CID 114931741

IUPAC2-[2-(aminomethyl)phenoxy]-N-(4,6-dimethyl-2-pyridinyl)acetamide
SMILESCc1cc(C)nc(NC(=O)COc2ccccc2CN)c1
InChIInChI=1S/C16H19N3O2/c1-11-7-12(2)18-15(8-11)19-16(20)10-21-14-6-4-3-5-13(14)9-17/h3-8H,9-10,17H2,1-2H3,(H,18,19,20)
InChIKeyUIKDGPJNZWATEF-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.17
Rot. Bonds5

About 2-[2-(aminomethyl)phenoxy]-N-(4,6-dimethyl-2-pyridinyl)acetamide

2-[2-(aminomethyl)phenoxy]-N-(4,6-dimethyl-2-pyridinyl)acetamide (PubChem CID 114931741) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 2-[2-(aminomethyl)phenoxy]-N-(4,6-dimethyl-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-[2-(aminomethyl)phenoxy]-N-(4,6-dimethyl-2-pyridinyl)acetamide
PubChem CID114931741
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name2-[2-(aminomethyl)phenoxy]-N-(4,6-dimethyl-2-pyridinyl)acetamide
SMILESCc1cc(C)nc(NC(=O)COc2ccccc2CN)c1
InChIInChI=1S/C16H19N3O2/c1-11-7-12(2)18-15(8-11)19-16(20)10-21-14-6-4-3-5-13(14)9-17/h3-8H,9-10,17H2,1-2H3,(H,18,19,20)
InChIKeyUIKDGPJNZWATEF-UHFFFAOYSA-N
XLogP2.17
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(aminomethyl)phenoxy]-N-pyridazin-3-ylacetamide
CID 116786130
2-[2-(aminomethyl)phenoxy]-N-(4-fluoro-3-methylphenyl)acetamide
CID 62808750
2-[2-(aminomethyl)phenoxy]-N-[(4-methylphenyl)methyl]acetamide
CID 16795293
2-[2-(aminomethyl)phenoxy]-N-[(3-methylphenyl)methyl]acetamide
CID 60903946
2-(2-benzylphenoxy)-N-(2,4,6-trimethylphenyl)acetamide
CID 7899812
2-[2-(aminomethyl)phenoxy]-N-(2-methoxyethyl)acetamide
CID 16788914
N-(6-methyl-2-pyridinyl)-2-(2,3,5-trimethylphenoxy)acetamide
CID 887387
2-[2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethoxy]phenyl]acetic acid
CID 80723767
2-[2-(aminomethyl)phenoxy]acetic acid
CID 15103326
2-[2-(aminomethyl)-4-fluorophenoxy]-N-(2-methylphenyl)acetamide
CID 107694923
2-[2-(aminomethyl)-4-methylphenoxy]-N-(2-bromophenyl)acetamide
CID 63322380
2-(2-ethylphenoxy)-N-pyridin-2-ylacetamide
CID 47111739

Frequently Asked Questions

What is the IUPAC name of 2-[2-(aminomethyl)phenoxy]-N-(4,6-dimethyl-2-pyridinyl)acetamide?
The IUPAC name of 2-[2-(aminomethyl)phenoxy]-N-(4,6-dimethyl-2-pyridinyl)acetamide (CID 114931741) is 2-[2-(aminomethyl)phenoxy]-N-(4,6-dimethyl-2-pyridinyl)acetamide.
What is the SMILES notation for 2-[2-(aminomethyl)phenoxy]-N-(4,6-dimethyl-2-pyridinyl)acetamide?
The canonical SMILES for 2-[2-(aminomethyl)phenoxy]-N-(4,6-dimethyl-2-pyridinyl)acetamide is Cc1cc(C)nc(NC(=O)COc2ccccc2CN)c1.
What is the InChIKey of 2-[2-(aminomethyl)phenoxy]-N-(4,6-dimethyl-2-pyridinyl)acetamide?
The InChIKey is UIKDGPJNZWATEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-11-7-12(2)18-15(8-11)19-16(20)10-21-14-6-4-3-5-13(14)9-17/h3-8H,9-10,17H2,1-2H3,(H,18,19,20).
What are the key properties of 2-[2-(aminomethyl)phenoxy]-N-(4,6-dimethyl-2-pyridinyl)acetamide?
2-[2-(aminomethyl)phenoxy]-N-(4,6-dimethyl-2-pyridinyl)acetamide has a molecular weight of 285.35 g/mol, XLogP of 2.17, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(aminomethyl)phenoxy]-N-(4,6-dimethyl-2-pyridinyl)acetamide is sourced from PubChem (CID 114931741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).