N-(3-methyl-2-pyridinyl)-2-[(2-phenoxyacetyl)amino]acetamide

C16H17N3O3 — CID 17395946

IUPACN-(3-methyl-2-pyridinyl)-2-[(2-phenoxyacetyl)amino]acetamide
SMILESCc1cccnc1NC(=O)CNC(=O)COc1ccccc1
InChIInChI=1S/C16H17N3O3/c1-12-6-5-9-17-16(12)19-14(20)10-18-15(21)11-22-13-7-3-2-4-8-13/h2-9H,10-11H2,1H3,(H,18,21)(H,17,19,20)
InChIKeySFDNLKVMMXABQM-UHFFFAOYSA-N
MW299.33 g/mol
LogP1.52
Rot. Bonds6

About N-(3-methyl-2-pyridinyl)-2-[(2-phenoxyacetyl)amino]acetamide

N-(3-methyl-2-pyridinyl)-2-[(2-phenoxyacetyl)amino]acetamide (PubChem CID 17395946) has the molecular formula C16H17N3O3 and a molecular weight of 299.33 g/mol. Its IUPAC name is N-(3-methyl-2-pyridinyl)-2-[(2-phenoxyacetyl)amino]acetamide.

Molecular Properties

Compound NameN-(3-methyl-2-pyridinyl)-2-[(2-phenoxyacetyl)amino]acetamide
PubChem CID17395946
Molecular FormulaC16H17N3O3
Molecular Weight299.33 g/mol
Exact Mass299.13
IUPAC NameN-(3-methyl-2-pyridinyl)-2-[(2-phenoxyacetyl)amino]acetamide
SMILESCc1cccnc1NC(=O)CNC(=O)COc1ccccc1
InChIInChI=1S/C16H17N3O3/c1-12-6-5-9-17-16(12)19-14(20)10-18-15(21)11-22-13-7-3-2-4-8-13/h2-9H,10-11H2,1H3,(H,18,21)(H,17,19,20)
InChIKeySFDNLKVMMXABQM-UHFFFAOYSA-N
XLogP1.52
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-methyl-2-pyridinyl)-2-[(2-phenoxyacetyl)amino]acetamide?
The IUPAC name of N-(3-methyl-2-pyridinyl)-2-[(2-phenoxyacetyl)amino]acetamide (CID 17395946) is N-(3-methyl-2-pyridinyl)-2-[(2-phenoxyacetyl)amino]acetamide.
What is the SMILES notation for N-(3-methyl-2-pyridinyl)-2-[(2-phenoxyacetyl)amino]acetamide?
The canonical SMILES for N-(3-methyl-2-pyridinyl)-2-[(2-phenoxyacetyl)amino]acetamide is Cc1cccnc1NC(=O)CNC(=O)COc1ccccc1.
What is the InChIKey of N-(3-methyl-2-pyridinyl)-2-[(2-phenoxyacetyl)amino]acetamide?
The InChIKey is SFDNLKVMMXABQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O3/c1-12-6-5-9-17-16(12)19-14(20)10-18-15(21)11-22-13-7-3-2-4-8-13/h2-9H,10-11H2,1H3,(H,18,21)(H,17,19,20).
What are the key properties of N-(3-methyl-2-pyridinyl)-2-[(2-phenoxyacetyl)amino]acetamide?
N-(3-methyl-2-pyridinyl)-2-[(2-phenoxyacetyl)amino]acetamide has a molecular weight of 299.33 g/mol, XLogP of 1.52, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methyl-2-pyridinyl)-2-[(2-phenoxyacetyl)amino]acetamide is sourced from PubChem (CID 17395946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).