N-(4-ethylcyclohexyl)-2-methoxypropanamide

C12H23NO2 — CID 115588230

IUPACN-(4-ethylcyclohexyl)-2-methoxypropanamide
SMILESCCC1CCC(NC(=O)C(C)OC)CC1
InChIInChI=1S/C12H23NO2/c1-4-10-5-7-11(8-6-10)13-12(14)9(2)15-3/h9-11H,4-8H2,1-3H3,(H,13,14)
InChIKeyQAPCMNXZZCNTNH-UHFFFAOYSA-N
MW213.32 g/mol
LogP2.11
Rot. Bonds4

About N-(4-ethylcyclohexyl)-2-methoxypropanamide

N-(4-ethylcyclohexyl)-2-methoxypropanamide (PubChem CID 115588230) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is N-(4-ethylcyclohexyl)-2-methoxypropanamide.

Molecular Properties

Compound NameN-(4-ethylcyclohexyl)-2-methoxypropanamide
PubChem CID115588230
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC NameN-(4-ethylcyclohexyl)-2-methoxypropanamide
SMILESCCC1CCC(NC(=O)C(C)OC)CC1
InChIInChI=1S/C12H23NO2/c1-4-10-5-7-11(8-6-10)13-12(14)9(2)15-3/h9-11H,4-8H2,1-3H3,(H,13,14)
InChIKeyQAPCMNXZZCNTNH-UHFFFAOYSA-N
XLogP2.11
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-ethylcyclohexyl)-2-methoxypropanamide?
The IUPAC name of N-(4-ethylcyclohexyl)-2-methoxypropanamide (CID 115588230) is N-(4-ethylcyclohexyl)-2-methoxypropanamide.
What is the SMILES notation for N-(4-ethylcyclohexyl)-2-methoxypropanamide?
The canonical SMILES for N-(4-ethylcyclohexyl)-2-methoxypropanamide is CCC1CCC(NC(=O)C(C)OC)CC1.
What is the InChIKey of N-(4-ethylcyclohexyl)-2-methoxypropanamide?
The InChIKey is QAPCMNXZZCNTNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-4-10-5-7-11(8-6-10)13-12(14)9(2)15-3/h9-11H,4-8H2,1-3H3,(H,13,14).
What are the key properties of N-(4-ethylcyclohexyl)-2-methoxypropanamide?
N-(4-ethylcyclohexyl)-2-methoxypropanamide has a molecular weight of 213.32 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylcyclohexyl)-2-methoxypropanamide is sourced from PubChem (CID 115588230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).