N-(4-aminocyclohexyl)-2-ethoxypropanamide

C11H22N2O2 — CID 119478328

IUPACN-(4-aminocyclohexyl)-2-ethoxypropanamide
SMILESCCOC(C)C(=O)NC1CCC(N)CC1
InChIInChI=1S/C11H22N2O2/c1-3-15-8(2)11(14)13-10-6-4-9(12)5-7-10/h8-10H,3-7,12H2,1-2H3,(H,13,14)
InChIKeyAVVJGCDMZFIGBN-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.80
Rot. Bonds4

About N-(4-aminocyclohexyl)-2-ethoxypropanamide

N-(4-aminocyclohexyl)-2-ethoxypropanamide (PubChem CID 119478328) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)-2-ethoxypropanamide.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)-2-ethoxypropanamide
PubChem CID119478328
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN-(4-aminocyclohexyl)-2-ethoxypropanamide
SMILESCCOC(C)C(=O)NC1CCC(N)CC1
InChIInChI=1S/C11H22N2O2/c1-3-15-8(2)11(14)13-10-6-4-9(12)5-7-10/h8-10H,3-7,12H2,1-2H3,(H,13,14)
InChIKeyAVVJGCDMZFIGBN-UHFFFAOYSA-N
XLogP0.80
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)-2-ethoxypropanamide?
The IUPAC name of N-(4-aminocyclohexyl)-2-ethoxypropanamide (CID 119478328) is N-(4-aminocyclohexyl)-2-ethoxypropanamide.
What is the SMILES notation for N-(4-aminocyclohexyl)-2-ethoxypropanamide?
The canonical SMILES for N-(4-aminocyclohexyl)-2-ethoxypropanamide is CCOC(C)C(=O)NC1CCC(N)CC1.
What is the InChIKey of N-(4-aminocyclohexyl)-2-ethoxypropanamide?
The InChIKey is AVVJGCDMZFIGBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-3-15-8(2)11(14)13-10-6-4-9(12)5-7-10/h8-10H,3-7,12H2,1-2H3,(H,13,14).
What are the key properties of N-(4-aminocyclohexyl)-2-ethoxypropanamide?
N-(4-aminocyclohexyl)-2-ethoxypropanamide has a molecular weight of 214.31 g/mol, XLogP of 0.80, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)-2-ethoxypropanamide is sourced from PubChem (CID 119478328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).