2-(3-ethoxycyclobutyl)-N-[2-(methylamino)propyl]acetamide

C12H24N2O2 — CID 103512576

IUPAC2-(3-ethoxycyclobutyl)-N-[2-(methylamino)propyl]acetamide
SMILESCCOC1CC(CC(=O)NCC(C)NC)C1
InChIInChI=1S/C12H24N2O2/c1-4-16-11-5-10(6-11)7-12(15)14-8-9(2)13-3/h9-11,13H,4-8H2,1-3H3,(H,14,15)
InChIKeyDBLBUGFKVNMLOT-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.92
Rot. Bonds7

About 2-(3-ethoxycyclobutyl)-N-[2-(methylamino)propyl]acetamide

2-(3-ethoxycyclobutyl)-N-[2-(methylamino)propyl]acetamide (PubChem CID 103512576) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-(3-ethoxycyclobutyl)-N-[2-(methylamino)propyl]acetamide.

Molecular Properties

Compound Name2-(3-ethoxycyclobutyl)-N-[2-(methylamino)propyl]acetamide
PubChem CID103512576
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name2-(3-ethoxycyclobutyl)-N-[2-(methylamino)propyl]acetamide
SMILESCCOC1CC(CC(=O)NCC(C)NC)C1
InChIInChI=1S/C12H24N2O2/c1-4-16-11-5-10(6-11)7-12(15)14-8-9(2)13-3/h9-11,13H,4-8H2,1-3H3,(H,14,15)
InChIKeyDBLBUGFKVNMLOT-UHFFFAOYSA-N
XLogP0.92
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-bromo-4-methylpentyl)-2-(3-ethoxycyclobutyl)acetamide
CID 107157895
2-(3-ethoxycyclobutyl)-N-(2-hydroxypentyl)acetamide
CID 103164764
N-butan-2-yl-2-(3-ethoxycyclobutyl)acetamide
CID 103164593
2-(3-ethoxycyclobutyl)-N-[(2S)-1-hydroxypropan-2-yl]acetamide
CID 103164701
2-cyclohexyl-N-[2-(methylamino)propyl]acetamide
CID 103512587
2-[[2-(3-ethoxycyclobutyl)acetyl]amino]acetic acid
CID 103161702
N-(1-aminopropan-2-yl)-2-(3-ethoxycyclobutyl)acetamide
CID 103164943
N-[2-(2-bromoethyl)pentyl]-2-(3-ethoxycyclobutyl)acetamide
CID 114145799
N-(4-chloropentan-2-yl)-2-(3-ethoxycyclobutyl)acetamide
CID 103166851
N-(3-chloropropyl)-2-(3-ethoxycyclobutyl)acetamide
CID 103164383
N-[(4-chlorocyclohexyl)methyl]-2-(3-ethoxycyclobutyl)acetamide
CID 114147988
N-(5-amino-4-methylpentyl)-2-(3-ethoxycyclobutyl)acetamide
CID 106153157

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethoxycyclobutyl)-N-[2-(methylamino)propyl]acetamide?
The IUPAC name of 2-(3-ethoxycyclobutyl)-N-[2-(methylamino)propyl]acetamide (CID 103512576) is 2-(3-ethoxycyclobutyl)-N-[2-(methylamino)propyl]acetamide.
What is the SMILES notation for 2-(3-ethoxycyclobutyl)-N-[2-(methylamino)propyl]acetamide?
The canonical SMILES for 2-(3-ethoxycyclobutyl)-N-[2-(methylamino)propyl]acetamide is CCOC1CC(CC(=O)NCC(C)NC)C1.
What is the InChIKey of 2-(3-ethoxycyclobutyl)-N-[2-(methylamino)propyl]acetamide?
The InChIKey is DBLBUGFKVNMLOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-4-16-11-5-10(6-11)7-12(15)14-8-9(2)13-3/h9-11,13H,4-8H2,1-3H3,(H,14,15).
What are the key properties of 2-(3-ethoxycyclobutyl)-N-[2-(methylamino)propyl]acetamide?
2-(3-ethoxycyclobutyl)-N-[2-(methylamino)propyl]acetamide has a molecular weight of 228.34 g/mol, XLogP of 0.92, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethoxycyclobutyl)-N-[2-(methylamino)propyl]acetamide is sourced from PubChem (CID 103512576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).