N-cyclopropyl-2-(2-methoxyethylamino)-N-(3-methylbutyl)acetamide

C13H26N2O2 — CID 79282070

IUPACN-cyclopropyl-2-(2-methoxyethylamino)-N-(3-methylbutyl)acetamide
SMILESCOCCNCC(=O)N(CCC(C)C)C1CC1
InChIInChI=1S/C13H26N2O2/c1-11(2)6-8-15(12-4-5-12)13(16)10-14-7-9-17-3/h11-12,14H,4-10H2,1-3H3
InChIKeyLDPGACIUPZYWCF-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.26
Rot. Bonds9

About N-cyclopropyl-2-(2-methoxyethylamino)-N-(3-methylbutyl)acetamide

N-cyclopropyl-2-(2-methoxyethylamino)-N-(3-methylbutyl)acetamide (PubChem CID 79282070) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is N-cyclopropyl-2-(2-methoxyethylamino)-N-(3-methylbutyl)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(2-methoxyethylamino)-N-(3-methylbutyl)acetamide
PubChem CID79282070
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC NameN-cyclopropyl-2-(2-methoxyethylamino)-N-(3-methylbutyl)acetamide
SMILESCOCCNCC(=O)N(CCC(C)C)C1CC1
InChIInChI=1S/C13H26N2O2/c1-11(2)6-8-15(12-4-5-12)13(16)10-14-7-9-17-3/h11-12,14H,4-10H2,1-3H3
InChIKeyLDPGACIUPZYWCF-UHFFFAOYSA-N
XLogP1.26
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-cyclopropyl-2-(2-methoxyethylamino)-N-propan-2-ylacetamide;hydrochloride
CID 119728071
N-cyclopropyl-N-(3-methylbutyl)-2-(prop-2-ynylamino)acetamide
CID 79286851
N-(cyclohexylmethyl)-N-cyclopropyl-2-(2-methoxyethylamino)acetamide
CID 79281659
N-cyclopropyl-N-ethyl-2-(3-methylbutylamino)acetamide
CID 60975211
N-cyclopentyl-N-(3-methylbutyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 78958467
N-benzyl-N-cyclopropyl-2-(2-methoxyethylamino)acetamide;hydrochloride
CID 119703228
2-bromo-N-cyclopropyl-N-(3-methylbutyl)acetamide
CID 63679316
N-cyclopropyl-N-[(4-fluorophenyl)methyl]-2-(2-methoxyethylamino)acetamide
CID 79282506
N-ethyl-2-(2-methoxyethylamino)-N-(2-methylpropyl)acetamide;hydrochloride
CID 119732327
N-(3-hydroxybutyl)-2-(2-methoxyethylamino)-N-methylacetamide
CID 115740129
2-(2-methoxyethylamino)-N-methyl-N-(2-methylcyclohexyl)acetamide
CID 79282069
N-cyclopropyl-2-(2-ethoxyethylamino)-N-ethylacetamide
CID 60976287

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(2-methoxyethylamino)-N-(3-methylbutyl)acetamide?
The IUPAC name of N-cyclopropyl-2-(2-methoxyethylamino)-N-(3-methylbutyl)acetamide (CID 79282070) is N-cyclopropyl-2-(2-methoxyethylamino)-N-(3-methylbutyl)acetamide.
What is the SMILES notation for N-cyclopropyl-2-(2-methoxyethylamino)-N-(3-methylbutyl)acetamide?
The canonical SMILES for N-cyclopropyl-2-(2-methoxyethylamino)-N-(3-methylbutyl)acetamide is COCCNCC(=O)N(CCC(C)C)C1CC1.
What is the InChIKey of N-cyclopropyl-2-(2-methoxyethylamino)-N-(3-methylbutyl)acetamide?
The InChIKey is LDPGACIUPZYWCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-11(2)6-8-15(12-4-5-12)13(16)10-14-7-9-17-3/h11-12,14H,4-10H2,1-3H3.
What are the key properties of N-cyclopropyl-2-(2-methoxyethylamino)-N-(3-methylbutyl)acetamide?
N-cyclopropyl-2-(2-methoxyethylamino)-N-(3-methylbutyl)acetamide has a molecular weight of 242.36 g/mol, XLogP of 1.26, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(2-methoxyethylamino)-N-(3-methylbutyl)acetamide is sourced from PubChem (CID 79282070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).