2-[cyclopropyl(1-cyclopropylethyl)amino]-N-[2-(2,6-dimethylphenoxy)ethyl]acetamide

C20H30N2O2 — CID 78896740

IUPAC2-[cyclopropyl(1-cyclopropylethyl)amino]-N-[2-(2,6-dimethylphenoxy)ethyl]acetamide
SMILESCc1cccc(C)c1OCCNC(=O)CN(C1CC1)C(C)C1CC1
InChIInChI=1S/C20H30N2O2/c1-14-5-4-6-15(2)20(14)24-12-11-21-19(23)13-22(18-9-10-18)16(3)17-7-8-17/h4-6,16-18H,7-13H2,1-3H3,(H,21,23)
InChIKeyMNQQNFGMIQOHGO-UHFFFAOYSA-N
MW330.47 g/mol
LogP3.06
Rot. Bonds9

About 2-[cyclopropyl(1-cyclopropylethyl)amino]-N-[2-(2,6-dimethylphenoxy)ethyl]acetamide

2-[cyclopropyl(1-cyclopropylethyl)amino]-N-[2-(2,6-dimethylphenoxy)ethyl]acetamide (PubChem CID 78896740) has the molecular formula C20H30N2O2 and a molecular weight of 330.47 g/mol. Its IUPAC name is 2-[cyclopropyl(1-cyclopropylethyl)amino]-N-[2-(2,6-dimethylphenoxy)ethyl]acetamide.

Molecular Properties

Compound Name2-[cyclopropyl(1-cyclopropylethyl)amino]-N-[2-(2,6-dimethylphenoxy)ethyl]acetamide
PubChem CID78896740
Molecular FormulaC20H30N2O2
Molecular Weight330.47 g/mol
Exact Mass330.23
IUPAC Name2-[cyclopropyl(1-cyclopropylethyl)amino]-N-[2-(2,6-dimethylphenoxy)ethyl]acetamide
SMILESCc1cccc(C)c1OCCNC(=O)CN(C1CC1)C(C)C1CC1
InChIInChI=1S/C20H30N2O2/c1-14-5-4-6-15(2)20(14)24-12-11-21-19(23)13-22(18-9-10-18)16(3)17-7-8-17/h4-6,16-18H,7-13H2,1-3H3,(H,21,23)
InChIKeyMNQQNFGMIQOHGO-UHFFFAOYSA-N
XLogP3.06
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.47
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-[cyclopropyl(1-cyclopropylethyl)amino]-N-[2-(2,6-dimethylphenoxy)ethyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(2,6-dimethylphenoxy)ethyl]-3-methylbutanamide
CID 113100718
2-[cyclopropyl(1-cyclopropylethyl)amino]-N-[2-[4-(trifluoromethoxy)phenyl]ethyl]acetamide
CID 78896739
2-[cyclopropyl-[2-[2-(3-fluorophenoxy)ethylamino]-2-oxoethyl]amino]propanoic acid
CID 122100687
N-(3-chlorophenyl)-2-[cyclopropyl(1-cyclopropylethyl)amino]acetamide
CID 46602371
cis-(1R,2S)-N-[2-[2-(2,6-dimethylphenoxy)ethylamino]-2-oxoethyl]-2-methylcyclopropane-1-carboxamide
CID 94184091
N-[2-(2,6-dimethylphenoxy)ethyl]-2-pyrrolidin-2-ylacetamide
CID 119734952
2-amino-N-[2-(2,6-dimethylphenoxy)ethyl]-3-methylpentanamide;hydrochloride
CID 119734945
2-[cyclopropyl(1-cyclopropylethyl)amino]-N-(phenylcarbamoyl)acetamide
CID 86983861
N-[2-(2,6-dimethylphenoxy)ethyl]-2-(3-hydroxypiperidin-1-yl)acetamide
CID 110897538
1-[2-(2,6-dimethylphenoxy)ethyl]-3-(2-methoxyethyl)urea
CID 47216835
N-(5-chloro-2-fluorophenyl)-2-[cyclopropyl(1-cyclopropylethyl)amino]acetamide
CID 46444172
2-[cyclopropyl-[2-(3,3-diphenylpropylamino)-2-oxoethyl]amino]propanoic acid
CID 122100872

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropyl(1-cyclopropylethyl)amino]-N-[2-(2,6-dimethylphenoxy)ethyl]acetamide?
The IUPAC name of 2-[cyclopropyl(1-cyclopropylethyl)amino]-N-[2-(2,6-dimethylphenoxy)ethyl]acetamide (CID 78896740) is 2-[cyclopropyl(1-cyclopropylethyl)amino]-N-[2-(2,6-dimethylphenoxy)ethyl]acetamide.
What is the SMILES notation for 2-[cyclopropyl(1-cyclopropylethyl)amino]-N-[2-(2,6-dimethylphenoxy)ethyl]acetamide?
The canonical SMILES for 2-[cyclopropyl(1-cyclopropylethyl)amino]-N-[2-(2,6-dimethylphenoxy)ethyl]acetamide is Cc1cccc(C)c1OCCNC(=O)CN(C1CC1)C(C)C1CC1.
What is the InChIKey of 2-[cyclopropyl(1-cyclopropylethyl)amino]-N-[2-(2,6-dimethylphenoxy)ethyl]acetamide?
The InChIKey is MNQQNFGMIQOHGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N2O2/c1-14-5-4-6-15(2)20(14)24-12-11-21-19(23)13-22(18-9-10-18)16(3)17-7-8-17/h4-6,16-18H,7-13H2,1-3H3,(H,21,23).
What are the key properties of 2-[cyclopropyl(1-cyclopropylethyl)amino]-N-[2-(2,6-dimethylphenoxy)ethyl]acetamide?
2-[cyclopropyl(1-cyclopropylethyl)amino]-N-[2-(2,6-dimethylphenoxy)ethyl]acetamide has a molecular weight of 330.47 g/mol, XLogP of 3.06, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropyl(1-cyclopropylethyl)amino]-N-[2-(2,6-dimethylphenoxy)ethyl]acetamide is sourced from PubChem (CID 78896740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).