N-[1-(4-ethoxyphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide

C16H26N2O2 — CID 62836048

IUPACN-[1-(4-ethoxyphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide
SMILESCCNC(C)(C)C(=O)NC(C)c1ccc(OCC)cc1
InChIInChI=1S/C16H26N2O2/c1-6-17-16(4,5)15(19)18-12(3)13-8-10-14(11-9-13)20-7-2/h8-12,17H,6-7H2,1-5H3,(H,18,19)
InChIKeyUCNXTMZHNHBBIL-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.65
Rot. Bonds7

About N-[1-(4-ethoxyphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide

N-[1-(4-ethoxyphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide (PubChem CID 62836048) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is N-[1-(4-ethoxyphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide.

Molecular Properties

Compound NameN-[1-(4-ethoxyphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide
PubChem CID62836048
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC NameN-[1-(4-ethoxyphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide
SMILESCCNC(C)(C)C(=O)NC(C)c1ccc(OCC)cc1
InChIInChI=1S/C16H26N2O2/c1-6-17-16(4,5)15(19)18-12(3)13-8-10-14(11-9-13)20-7-2/h8-12,17H,6-7H2,1-5H3,(H,18,19)
InChIKeyUCNXTMZHNHBBIL-UHFFFAOYSA-N
XLogP2.65
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-(4-ethoxyphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide?
The IUPAC name of N-[1-(4-ethoxyphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide (CID 62836048) is N-[1-(4-ethoxyphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide.
What is the SMILES notation for N-[1-(4-ethoxyphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide?
The canonical SMILES for N-[1-(4-ethoxyphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide is CCNC(C)(C)C(=O)NC(C)c1ccc(OCC)cc1.
What is the InChIKey of N-[1-(4-ethoxyphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide?
The InChIKey is UCNXTMZHNHBBIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-6-17-16(4,5)15(19)18-12(3)13-8-10-14(11-9-13)20-7-2/h8-12,17H,6-7H2,1-5H3,(H,18,19).
What are the key properties of N-[1-(4-ethoxyphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide?
N-[1-(4-ethoxyphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide has a molecular weight of 278.40 g/mol, XLogP of 2.65, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-ethoxyphenyl)ethyl]-2-(ethylamino)-2-methylpropanamide is sourced from PubChem (CID 62836048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).