2-cyclopropyl-2-(cyclopropylamino)-3-(3,4-dimethylphenoxy)propanamide

C17H24N2O2 — CID 63920781

IUPAC2-cyclopropyl-2-(cyclopropylamino)-3-(3,4-dimethylphenoxy)propanamide
SMILESCc1ccc(OCC(NC2CC2)(C(N)=O)C2CC2)cc1C
InChIInChI=1S/C17H24N2O2/c1-11-3-8-15(9-12(11)2)21-10-17(16(18)20,13-4-5-13)19-14-6-7-14/h3,8-9,13-14,19H,4-7,10H2,1-2H3,(H2,18,20)
InChIKeyWXZBACWJBSOFRB-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.07
Rot. Bonds7

About 2-cyclopropyl-2-(cyclopropylamino)-3-(3,4-dimethylphenoxy)propanamide

2-cyclopropyl-2-(cyclopropylamino)-3-(3,4-dimethylphenoxy)propanamide (PubChem CID 63920781) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is 2-cyclopropyl-2-(cyclopropylamino)-3-(3,4-dimethylphenoxy)propanamide.

Molecular Properties

Compound Name2-cyclopropyl-2-(cyclopropylamino)-3-(3,4-dimethylphenoxy)propanamide
PubChem CID63920781
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name2-cyclopropyl-2-(cyclopropylamino)-3-(3,4-dimethylphenoxy)propanamide
SMILESCc1ccc(OCC(NC2CC2)(C(N)=O)C2CC2)cc1C
InChIInChI=1S/C17H24N2O2/c1-11-3-8-15(9-12(11)2)21-10-17(16(18)20,13-4-5-13)19-14-6-7-14/h3,8-9,13-14,19H,4-7,10H2,1-2H3,(H2,18,20)
InChIKeyWXZBACWJBSOFRB-UHFFFAOYSA-N
XLogP2.07
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 2-cyclopropyl-2-(cyclopropylamino)-3-(3-methylphenoxy)propanoate
CID 63919019
ethyl 2-amino-2-cyclopropyl-3-(3,4-dimethylphenoxy)propanoate
CID 63921568
2-cyclopropyl-3-(3,4-difluorophenoxy)-2-(propan-2-ylamino)propanamide
CID 63920985
2-cyclopropyl-2-(cyclopropylamino)-3-[4-(hydroxymethyl)phenoxy]propanoic acid
CID 63921694
2-cyclopropyl-2-(cyclopropylamino)-3-heptoxypropanamide
CID 63920728
2-cyclopropyl-2-(cyclopropylamino)-3-(2-methylphenoxy)propanoic acid
CID 63919213
2-cyclopropyl-2-(methylamino)-3-(2-methyl-5-propan-2-ylphenoxy)propanamide
CID 63920114
2-cyclopropyl-2-(ethylamino)-3-(4-propan-2-ylphenoxy)propanamide
CID 63921557
N-(1-amino-2-cyclopropylpropan-2-yl)-2-(3,4-dimethylphenoxy)acetamide;hydrochloride
CID 119573205
2-cyclopropyl-3-(2,4-dimethylphenoxy)-2-(propan-2-ylamino)propanamide
CID 63920376
2-cyclopropyl-2-(cyclopropylamino)-3-(2-methylimidazol-1-yl)propanamide
CID 63919496
1-(3,4-dimethylphenoxy)-2-methylpropan-2-ol
CID 60878783

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-(cyclopropylamino)-3-(3,4-dimethylphenoxy)propanamide?
The IUPAC name of 2-cyclopropyl-2-(cyclopropylamino)-3-(3,4-dimethylphenoxy)propanamide (CID 63920781) is 2-cyclopropyl-2-(cyclopropylamino)-3-(3,4-dimethylphenoxy)propanamide.
What is the SMILES notation for 2-cyclopropyl-2-(cyclopropylamino)-3-(3,4-dimethylphenoxy)propanamide?
The canonical SMILES for 2-cyclopropyl-2-(cyclopropylamino)-3-(3,4-dimethylphenoxy)propanamide is Cc1ccc(OCC(NC2CC2)(C(N)=O)C2CC2)cc1C.
What is the InChIKey of 2-cyclopropyl-2-(cyclopropylamino)-3-(3,4-dimethylphenoxy)propanamide?
The InChIKey is WXZBACWJBSOFRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-11-3-8-15(9-12(11)2)21-10-17(16(18)20,13-4-5-13)19-14-6-7-14/h3,8-9,13-14,19H,4-7,10H2,1-2H3,(H2,18,20).
What are the key properties of 2-cyclopropyl-2-(cyclopropylamino)-3-(3,4-dimethylphenoxy)propanamide?
2-cyclopropyl-2-(cyclopropylamino)-3-(3,4-dimethylphenoxy)propanamide has a molecular weight of 288.39 g/mol, XLogP of 2.07, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-(cyclopropylamino)-3-(3,4-dimethylphenoxy)propanamide is sourced from PubChem (CID 63920781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).