N-[2-ethoxy-4-methoxy-3-(2-methylpropylamino)phenyl]acetamide

C15H24N2O3 — CID 70521499

IUPACN-[2-ethoxy-4-methoxy-3-(2-methylpropylamino)phenyl]acetamide
SMILESCCOc1c(NC(C)=O)ccc(OC)c1NCC(C)C
InChIInChI=1S/C15H24N2O3/c1-6-20-15-12(17-11(4)18)7-8-13(19-5)14(15)16-9-10(2)3/h7-8,10,16H,6,9H2,1-5H3,(H,17,18)
InChIKeySYEWJYKOHCTGPG-UHFFFAOYSA-N
MW280.37 g/mol
LogP3.12
Rot. Bonds7

About N-[2-ethoxy-4-methoxy-3-(2-methylpropylamino)phenyl]acetamide

N-[2-ethoxy-4-methoxy-3-(2-methylpropylamino)phenyl]acetamide (PubChem CID 70521499) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is N-[2-ethoxy-4-methoxy-3-(2-methylpropylamino)phenyl]acetamide.

Molecular Properties

Compound NameN-[2-ethoxy-4-methoxy-3-(2-methylpropylamino)phenyl]acetamide
PubChem CID70521499
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC NameN-[2-ethoxy-4-methoxy-3-(2-methylpropylamino)phenyl]acetamide
SMILESCCOc1c(NC(C)=O)ccc(OC)c1NCC(C)C
InChIInChI=1S/C15H24N2O3/c1-6-20-15-12(17-11(4)18)7-8-13(19-5)14(15)16-9-10(2)3/h7-8,10,16H,6,9H2,1-5H3,(H,17,18)
InChIKeySYEWJYKOHCTGPG-UHFFFAOYSA-N
XLogP3.12
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-ethoxy-4-methoxy-3-(2-methylpropylamino)phenyl]acetamide?
The IUPAC name of N-[2-ethoxy-4-methoxy-3-(2-methylpropylamino)phenyl]acetamide (CID 70521499) is N-[2-ethoxy-4-methoxy-3-(2-methylpropylamino)phenyl]acetamide.
What is the SMILES notation for N-[2-ethoxy-4-methoxy-3-(2-methylpropylamino)phenyl]acetamide?
The canonical SMILES for N-[2-ethoxy-4-methoxy-3-(2-methylpropylamino)phenyl]acetamide is CCOc1c(NC(C)=O)ccc(OC)c1NCC(C)C.
What is the InChIKey of N-[2-ethoxy-4-methoxy-3-(2-methylpropylamino)phenyl]acetamide?
The InChIKey is SYEWJYKOHCTGPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-6-20-15-12(17-11(4)18)7-8-13(19-5)14(15)16-9-10(2)3/h7-8,10,16H,6,9H2,1-5H3,(H,17,18).
What are the key properties of N-[2-ethoxy-4-methoxy-3-(2-methylpropylamino)phenyl]acetamide?
N-[2-ethoxy-4-methoxy-3-(2-methylpropylamino)phenyl]acetamide has a molecular weight of 280.37 g/mol, XLogP of 3.12, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-ethoxy-4-methoxy-3-(2-methylpropylamino)phenyl]acetamide is sourced from PubChem (CID 70521499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).