2-cyclopropyl-2-(ethylamino)-3-(4-propan-2-ylphenoxy)propanamide

C17H26N2O2 — CID 63921557

IUPAC2-cyclopropyl-2-(ethylamino)-3-(4-propan-2-ylphenoxy)propanamide
SMILESCCNC(COc1ccc(C(C)C)cc1)(C(N)=O)C1CC1
InChIInChI=1S/C17H26N2O2/c1-4-19-17(16(18)20,14-7-8-14)11-21-15-9-5-13(6-10-15)12(2)3/h5-6,9-10,12,14,19H,4,7-8,11H2,1-3H3,(H2,18,20)
InChIKeyACQFOQYFXXSKEE-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.43
Rot. Bonds8

About 2-cyclopropyl-2-(ethylamino)-3-(4-propan-2-ylphenoxy)propanamide

2-cyclopropyl-2-(ethylamino)-3-(4-propan-2-ylphenoxy)propanamide (PubChem CID 63921557) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 2-cyclopropyl-2-(ethylamino)-3-(4-propan-2-ylphenoxy)propanamide.

Molecular Properties

Compound Name2-cyclopropyl-2-(ethylamino)-3-(4-propan-2-ylphenoxy)propanamide
PubChem CID63921557
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name2-cyclopropyl-2-(ethylamino)-3-(4-propan-2-ylphenoxy)propanamide
SMILESCCNC(COc1ccc(C(C)C)cc1)(C(N)=O)C1CC1
InChIInChI=1S/C17H26N2O2/c1-4-19-17(16(18)20,14-7-8-14)11-21-15-9-5-13(6-10-15)12(2)3/h5-6,9-10,12,14,19H,4,7-8,11H2,1-3H3,(H2,18,20)
InChIKeyACQFOQYFXXSKEE-UHFFFAOYSA-N
XLogP2.43
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-(ethylamino)-3-(4-propan-2-ylphenoxy)propanamide?
The IUPAC name of 2-cyclopropyl-2-(ethylamino)-3-(4-propan-2-ylphenoxy)propanamide (CID 63921557) is 2-cyclopropyl-2-(ethylamino)-3-(4-propan-2-ylphenoxy)propanamide.
What is the SMILES notation for 2-cyclopropyl-2-(ethylamino)-3-(4-propan-2-ylphenoxy)propanamide?
The canonical SMILES for 2-cyclopropyl-2-(ethylamino)-3-(4-propan-2-ylphenoxy)propanamide is CCNC(COc1ccc(C(C)C)cc1)(C(N)=O)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-(ethylamino)-3-(4-propan-2-ylphenoxy)propanamide?
The InChIKey is ACQFOQYFXXSKEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-4-19-17(16(18)20,14-7-8-14)11-21-15-9-5-13(6-10-15)12(2)3/h5-6,9-10,12,14,19H,4,7-8,11H2,1-3H3,(H2,18,20).
What are the key properties of 2-cyclopropyl-2-(ethylamino)-3-(4-propan-2-ylphenoxy)propanamide?
2-cyclopropyl-2-(ethylamino)-3-(4-propan-2-ylphenoxy)propanamide has a molecular weight of 290.41 g/mol, XLogP of 2.43, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-(ethylamino)-3-(4-propan-2-ylphenoxy)propanamide is sourced from PubChem (CID 63921557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).