N-[4-[4-(methylamino)phenoxy]-2-pyridinyl]acetamide

C14H15N3O2 — CID 138528462

IUPACN-[4-[4-(methylamino)phenoxy]-2-pyridinyl]acetamide
SMILESCNc1ccc(Oc2ccnc(NC(C)=O)c2)cc1
InChIInChI=1S/C14H15N3O2/c1-10(18)17-14-9-13(7-8-16-14)19-12-5-3-11(15-2)4-6-12/h3-9,15H,1-2H3,(H,16,17,18)
InChIKeyLGGIOGMWAWZFCL-UHFFFAOYSA-N
MW257.29 g/mol
LogP2.87
Rot. Bonds4

About N-[4-[4-(methylamino)phenoxy]-2-pyridinyl]acetamide

N-[4-[4-(methylamino)phenoxy]-2-pyridinyl]acetamide (PubChem CID 138528462) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is N-[4-[4-(methylamino)phenoxy]-2-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[4-[4-(methylamino)phenoxy]-2-pyridinyl]acetamide
PubChem CID138528462
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC NameN-[4-[4-(methylamino)phenoxy]-2-pyridinyl]acetamide
SMILESCNc1ccc(Oc2ccnc(NC(C)=O)c2)cc1
InChIInChI=1S/C14H15N3O2/c1-10(18)17-14-9-13(7-8-16-14)19-12-5-3-11(15-2)4-6-12/h3-9,15H,1-2H3,(H,16,17,18)
InChIKeyLGGIOGMWAWZFCL-UHFFFAOYSA-N
XLogP2.87
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[4-[4-(methylamino)phenoxy]-2-pyridinyl]acetamide?
The IUPAC name of N-[4-[4-(methylamino)phenoxy]-2-pyridinyl]acetamide (CID 138528462) is N-[4-[4-(methylamino)phenoxy]-2-pyridinyl]acetamide.
What is the SMILES notation for N-[4-[4-(methylamino)phenoxy]-2-pyridinyl]acetamide?
The canonical SMILES for N-[4-[4-(methylamino)phenoxy]-2-pyridinyl]acetamide is CNc1ccc(Oc2ccnc(NC(C)=O)c2)cc1.
What is the InChIKey of N-[4-[4-(methylamino)phenoxy]-2-pyridinyl]acetamide?
The InChIKey is LGGIOGMWAWZFCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-10(18)17-14-9-13(7-8-16-14)19-12-5-3-11(15-2)4-6-12/h3-9,15H,1-2H3,(H,16,17,18).
What are the key properties of N-[4-[4-(methylamino)phenoxy]-2-pyridinyl]acetamide?
N-[4-[4-(methylamino)phenoxy]-2-pyridinyl]acetamide has a molecular weight of 257.29 g/mol, XLogP of 2.87, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[4-(methylamino)phenoxy]-2-pyridinyl]acetamide is sourced from PubChem (CID 138528462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).