N-methyl-2-[3-(2-methylpentylamino)phenoxy]acetamide

C15H24N2O2 — CID 43693343

IUPACN-methyl-2-[3-(2-methylpentylamino)phenoxy]acetamide
SMILESCCCC(C)CNc1cccc(OCC(=O)NC)c1
InChIInChI=1S/C15H24N2O2/c1-4-6-12(2)10-17-13-7-5-8-14(9-13)19-11-15(18)16-3/h5,7-9,12,17H,4,6,10-11H2,1-3H3,(H,16,18)
InChIKeyUBRXYRGAVPIFDP-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.66
Rot. Bonds8

About N-methyl-2-[3-(2-methylpentylamino)phenoxy]acetamide

N-methyl-2-[3-(2-methylpentylamino)phenoxy]acetamide (PubChem CID 43693343) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-methyl-2-[3-(2-methylpentylamino)phenoxy]acetamide.

Molecular Properties

Compound NameN-methyl-2-[3-(2-methylpentylamino)phenoxy]acetamide
PubChem CID43693343
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-methyl-2-[3-(2-methylpentylamino)phenoxy]acetamide
SMILESCCCC(C)CNc1cccc(OCC(=O)NC)c1
InChIInChI=1S/C15H24N2O2/c1-4-6-12(2)10-17-13-7-5-8-14(9-13)19-11-15(18)16-3/h5,7-9,12,17H,4,6,10-11H2,1-3H3,(H,16,18)
InChIKeyUBRXYRGAVPIFDP-UHFFFAOYSA-N
XLogP2.66
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[3-(2-methylpentylamino)phenoxy]acetamide?
The IUPAC name of N-methyl-2-[3-(2-methylpentylamino)phenoxy]acetamide (CID 43693343) is N-methyl-2-[3-(2-methylpentylamino)phenoxy]acetamide.
What is the SMILES notation for N-methyl-2-[3-(2-methylpentylamino)phenoxy]acetamide?
The canonical SMILES for N-methyl-2-[3-(2-methylpentylamino)phenoxy]acetamide is CCCC(C)CNc1cccc(OCC(=O)NC)c1.
What is the InChIKey of N-methyl-2-[3-(2-methylpentylamino)phenoxy]acetamide?
The InChIKey is UBRXYRGAVPIFDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-4-6-12(2)10-17-13-7-5-8-14(9-13)19-11-15(18)16-3/h5,7-9,12,17H,4,6,10-11H2,1-3H3,(H,16,18).
What are the key properties of N-methyl-2-[3-(2-methylpentylamino)phenoxy]acetamide?
N-methyl-2-[3-(2-methylpentylamino)phenoxy]acetamide has a molecular weight of 264.37 g/mol, XLogP of 2.66, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[3-(2-methylpentylamino)phenoxy]acetamide is sourced from PubChem (CID 43693343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).