N-(3-aminopropyl)-N-cyclopropyl-3-ethoxypropanamide

C11H22N2O2 — CID 62588782

IUPACN-(3-aminopropyl)-N-cyclopropyl-3-ethoxypropanamide
SMILESCCOCCC(=O)N(CCCN)C1CC1
InChIInChI=1S/C11H22N2O2/c1-2-15-9-6-11(14)13(8-3-7-12)10-4-5-10/h10H,2-9,12H2,1H3
InChIKeyYSIQDNXLMHRJIH-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.75
Rot. Bonds8

About N-(3-aminopropyl)-N-cyclopropyl-3-ethoxypropanamide

N-(3-aminopropyl)-N-cyclopropyl-3-ethoxypropanamide (PubChem CID 62588782) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N-(3-aminopropyl)-N-cyclopropyl-3-ethoxypropanamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-N-cyclopropyl-3-ethoxypropanamide
PubChem CID62588782
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN-(3-aminopropyl)-N-cyclopropyl-3-ethoxypropanamide
SMILESCCOCCC(=O)N(CCCN)C1CC1
InChIInChI=1S/C11H22N2O2/c1-2-15-9-6-11(14)13(8-3-7-12)10-4-5-10/h10H,2-9,12H2,1H3
InChIKeyYSIQDNXLMHRJIH-UHFFFAOYSA-N
XLogP0.75
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.75
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-(3-aminopropyl)-N-cyclopentyl-3-ethoxypropanamide
CID 62588970
N-(3-aminopropyl)-N-cyclohexyl-3-propoxypropanamide
CID 62688230
N-(3-aminopropyl)-N-cyclopropyloctanamide
CID 43136708
3-amino-N-butyl-N-cyclopropylpropanamide
CID 60944847
N-(3-aminopropyl)-N-cycloheptylbutanamide
CID 43136885
N-(3-aminopropyl)-N-cyclobutylhexanamide
CID 102873870
N-(5-aminopentyl)-3-ethoxy-N-methylpropanamide
CID 107206617
3-amino-N-(3-aminopropyl)-N-cyclohexylpropanamide
CID 134484716
N-(3-aminopropyl)-N-cycloheptylheptanamide
CID 114751887
methyl N-(3-aminopropyl)-N-cyclopropylcarbamate
CID 43137085
N-(3-aminopropyl)-N-cyclopropyl-2-methylbutanamide
CID 43136751
1-(3-aminopropyl)-1-cyclopropyl-3,3-diethylurea
CID 79154786

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-N-cyclopropyl-3-ethoxypropanamide?
The IUPAC name of N-(3-aminopropyl)-N-cyclopropyl-3-ethoxypropanamide (CID 62588782) is N-(3-aminopropyl)-N-cyclopropyl-3-ethoxypropanamide.
What is the SMILES notation for N-(3-aminopropyl)-N-cyclopropyl-3-ethoxypropanamide?
The canonical SMILES for N-(3-aminopropyl)-N-cyclopropyl-3-ethoxypropanamide is CCOCCC(=O)N(CCCN)C1CC1.
What is the InChIKey of N-(3-aminopropyl)-N-cyclopropyl-3-ethoxypropanamide?
The InChIKey is YSIQDNXLMHRJIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-2-15-9-6-11(14)13(8-3-7-12)10-4-5-10/h10H,2-9,12H2,1H3.
What are the key properties of N-(3-aminopropyl)-N-cyclopropyl-3-ethoxypropanamide?
N-(3-aminopropyl)-N-cyclopropyl-3-ethoxypropanamide has a molecular weight of 214.31 g/mol, XLogP of 0.75, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-N-cyclopropyl-3-ethoxypropanamide is sourced from PubChem (CID 62588782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).