2-cyclopropyl-3-(4-ethylphenoxy)-2-(propan-2-ylamino)propanamide

C17H26N2O2 — CID 63919201

IUPAC2-cyclopropyl-3-(4-ethylphenoxy)-2-(propan-2-ylamino)propanamide
SMILESCCc1ccc(OCC(NC(C)C)(C(N)=O)C2CC2)cc1
InChIInChI=1S/C17H26N2O2/c1-4-13-5-9-15(10-6-13)21-11-17(16(18)20,14-7-8-14)19-12(2)3/h5-6,9-10,12,14,19H,4,7-8,11H2,1-3H3,(H2,18,20)
InChIKeyGPGDZMSYGTZSOJ-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.26
Rot. Bonds8

About 2-cyclopropyl-3-(4-ethylphenoxy)-2-(propan-2-ylamino)propanamide

2-cyclopropyl-3-(4-ethylphenoxy)-2-(propan-2-ylamino)propanamide (PubChem CID 63919201) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 2-cyclopropyl-3-(4-ethylphenoxy)-2-(propan-2-ylamino)propanamide.

Molecular Properties

Compound Name2-cyclopropyl-3-(4-ethylphenoxy)-2-(propan-2-ylamino)propanamide
PubChem CID63919201
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name2-cyclopropyl-3-(4-ethylphenoxy)-2-(propan-2-ylamino)propanamide
SMILESCCc1ccc(OCC(NC(C)C)(C(N)=O)C2CC2)cc1
InChIInChI=1S/C17H26N2O2/c1-4-13-5-9-15(10-6-13)21-11-17(16(18)20,14-7-8-14)19-12(2)3/h5-6,9-10,12,14,19H,4,7-8,11H2,1-3H3,(H2,18,20)
InChIKeyGPGDZMSYGTZSOJ-UHFFFAOYSA-N
XLogP2.26
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 ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopropyl-3-(3,4-difluorophenoxy)-2-(propan-2-ylamino)propanamide
CID 63920985
2-cyclopropyl-2-(ethylamino)-3-(4-propan-2-ylphenoxy)propanamide
CID 63921557
2-cyclopropyl-3-(2,4-dimethylphenoxy)-2-(propan-2-ylamino)propanamide
CID 63920376
2-cyclopropyl-3-(2-methoxyethoxy)-2-(propan-2-ylamino)propanamide
CID 63919567
2-cyclopropyl-3-octoxy-2-(propan-2-ylamino)propanamide
CID 63918759
methyl 2-cyclopropyl-3-(3-methylphenoxy)-2-(propan-2-ylamino)propanoate
CID 63918634
2-cyclopropyl-3-phenylsulfanyl-2-(propan-2-ylamino)propanamide
CID 63916309
2-cyclopropyl-2-(cyclopropylamino)-3-(3,4-dimethylphenoxy)propanamide
CID 63920781
3-(4-butan-2-ylphenoxy)-2-cyclopropyl-2-(methylamino)propanoic acid
CID 107667914
N-cyclopropyl-2-(4-ethylphenoxy)propanamide
CID 60625156
methyl 2-cyclopropyl-2-(methylamino)-3-(4-propan-2-ylphenoxy)propanoate
CID 63918613
2-cyclopropyl-3-(2,6-dimethylphenoxy)-2-(propan-2-ylamino)propanoic acid
CID 63918609

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-3-(4-ethylphenoxy)-2-(propan-2-ylamino)propanamide?
The IUPAC name of 2-cyclopropyl-3-(4-ethylphenoxy)-2-(propan-2-ylamino)propanamide (CID 63919201) is 2-cyclopropyl-3-(4-ethylphenoxy)-2-(propan-2-ylamino)propanamide.
What is the SMILES notation for 2-cyclopropyl-3-(4-ethylphenoxy)-2-(propan-2-ylamino)propanamide?
The canonical SMILES for 2-cyclopropyl-3-(4-ethylphenoxy)-2-(propan-2-ylamino)propanamide is CCc1ccc(OCC(NC(C)C)(C(N)=O)C2CC2)cc1.
What is the InChIKey of 2-cyclopropyl-3-(4-ethylphenoxy)-2-(propan-2-ylamino)propanamide?
The InChIKey is GPGDZMSYGTZSOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-4-13-5-9-15(10-6-13)21-11-17(16(18)20,14-7-8-14)19-12(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-3-(4-ethylphenoxy)-2-(propan-2-ylamino)propanamide?
2-cyclopropyl-3-(4-ethylphenoxy)-2-(propan-2-ylamino)propanamide has a molecular weight of 290.41 g/mol, XLogP of 2.26, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-3-(4-ethylphenoxy)-2-(propan-2-ylamino)propanamide is sourced from PubChem (CID 63919201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).