2-cyclopropyl-2-(ethylamino)-3-heptoxypropanamide

C15H30N2O2 — CID 63921120

IUPAC2-cyclopropyl-2-(ethylamino)-3-heptoxypropanamide
SMILESCCCCCCCOCC(NCC)(C(N)=O)C1CC1
InChIInChI=1S/C15H30N2O2/c1-3-5-6-7-8-11-19-12-15(14(16)18,17-4-2)13-9-10-13/h13,17H,3-12H2,1-2H3,(H2,16,18)
InChIKeyALSSUHMKLAVYEX-UHFFFAOYSA-N
MW270.42 g/mol
LogP2.22
Rot. Bonds12

About 2-cyclopropyl-2-(ethylamino)-3-heptoxypropanamide

2-cyclopropyl-2-(ethylamino)-3-heptoxypropanamide (PubChem CID 63921120) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 2-cyclopropyl-2-(ethylamino)-3-heptoxypropanamide.

Molecular Properties

Compound Name2-cyclopropyl-2-(ethylamino)-3-heptoxypropanamide
PubChem CID63921120
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC Name2-cyclopropyl-2-(ethylamino)-3-heptoxypropanamide
SMILESCCCCCCCOCC(NCC)(C(N)=O)C1CC1
InChIInChI=1S/C15H30N2O2/c1-3-5-6-7-8-11-19-12-15(14(16)18,17-4-2)13-9-10-13/h13,17H,3-12H2,1-2H3,(H2,16,18)
InChIKeyALSSUHMKLAVYEX-UHFFFAOYSA-N
XLogP2.22
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-butoxy-2-cyclopropyl-2-(ethylamino)propanamide
CID 63918660
3-(2-butoxyethoxy)-2-cyclopropyl-2-(ethylamino)propanamide
CID 63919349
2-cyclopropyl-3-octoxy-2-(propylamino)propanamide
CID 63921706
2-cyclopropyl-2-(cyclopropylamino)-3-heptoxypropanamide
CID 63920728
2-cyclopropyl-3-octoxy-2-(propan-2-ylamino)propanamide
CID 63918759
2-cyclopropyl-2-(ethylamino)-3-(3-methylbutoxy)propanamide
CID 63921332
2-cyclopropyl-2-(ethylamino)-3-(2-ethylhexoxy)propanamide
CID 63919546
ethyl 2-cyclopropyl-3-heptoxy-2-(methylamino)propanoate
CID 63921121
3-butylsulfanyl-2-cyclopropyl-2-(ethylamino)propanamide
CID 63918024
2-cyclopropyl-3-octoxy-2-(propan-2-ylamino)propanoic acid
CID 63919147
2-cyclopropyl-2-(ethylamino)-3-(oxan-4-yloxy)propanamide
CID 63920320
2-cyclopropyl-2-(ethylamino)-3-heptoxypropan-1-ol
CID 64803350

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-(ethylamino)-3-heptoxypropanamide?
The IUPAC name of 2-cyclopropyl-2-(ethylamino)-3-heptoxypropanamide (CID 63921120) is 2-cyclopropyl-2-(ethylamino)-3-heptoxypropanamide.
What is the SMILES notation for 2-cyclopropyl-2-(ethylamino)-3-heptoxypropanamide?
The canonical SMILES for 2-cyclopropyl-2-(ethylamino)-3-heptoxypropanamide is CCCCCCCOCC(NCC)(C(N)=O)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-(ethylamino)-3-heptoxypropanamide?
The InChIKey is ALSSUHMKLAVYEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-3-5-6-7-8-11-19-12-15(14(16)18,17-4-2)13-9-10-13/h13,17H,3-12H2,1-2H3,(H2,16,18).
What are the key properties of 2-cyclopropyl-2-(ethylamino)-3-heptoxypropanamide?
2-cyclopropyl-2-(ethylamino)-3-heptoxypropanamide has a molecular weight of 270.42 g/mol, XLogP of 2.22, 12 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-(ethylamino)-3-heptoxypropanamide is sourced from PubChem (CID 63921120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).