2-[1-(aminomethyl)-4-ethylcyclohexyl]oxy-N-(2-methoxyethyl)propanamide

C15H30N2O3 — CID 65052742

IUPAC2-[1-(aminomethyl)-4-ethylcyclohexyl]oxy-N-(2-methoxyethyl)propanamide
SMILESCCC1CCC(CN)(OC(C)C(=O)NCCOC)CC1
InChIInChI=1S/C15H30N2O3/c1-4-13-5-7-15(11-16,8-6-13)20-12(2)14(18)17-9-10-19-3/h12-13H,4-11,16H2,1-3H3,(H,17,18)
InChIKeyGUGQTDSLOWYYCY-UHFFFAOYSA-N
MW286.42 g/mol
LogP1.45
Rot. Bonds8

About 2-[1-(aminomethyl)-4-ethylcyclohexyl]oxy-N-(2-methoxyethyl)propanamide

2-[1-(aminomethyl)-4-ethylcyclohexyl]oxy-N-(2-methoxyethyl)propanamide (PubChem CID 65052742) has the molecular formula C15H30N2O3 and a molecular weight of 286.42 g/mol. Its IUPAC name is 2-[1-(aminomethyl)-4-ethylcyclohexyl]oxy-N-(2-methoxyethyl)propanamide.

Molecular Properties

Compound Name2-[1-(aminomethyl)-4-ethylcyclohexyl]oxy-N-(2-methoxyethyl)propanamide
PubChem CID65052742
Molecular FormulaC15H30N2O3
Molecular Weight286.42 g/mol
Exact Mass286.23
IUPAC Name2-[1-(aminomethyl)-4-ethylcyclohexyl]oxy-N-(2-methoxyethyl)propanamide
SMILESCCC1CCC(CN)(OC(C)C(=O)NCCOC)CC1
InChIInChI=1S/C15H30N2O3/c1-4-13-5-7-15(11-16,8-6-13)20-12(2)14(18)17-9-10-19-3/h12-13H,4-11,16H2,1-3H3,(H,17,18)
InChIKeyGUGQTDSLOWYYCY-UHFFFAOYSA-N
XLogP1.45
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-[1-(aminomethyl)-4-ethylcyclohexyl]oxy-N-(2-methoxyethyl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[1-(aminomethyl)-4-methylcyclohexyl]oxy-N-(2-methoxyethyl)propanamide
CID 65051160
2-[1-(aminomethyl)-4,4-dimethylcyclohexyl]oxy-N-(2-methoxyethyl)propanamide
CID 65050735
2-[1-(aminomethyl)-4-ethylcyclohexyl]oxy-1-piperidin-1-ylpropan-1-one
CID 65052797
2-[1-(aminomethyl)cyclopentyl]oxy-N-butylpropanamide
CID 65051029
2-[1-(aminomethyl)cycloheptyl]oxy-N-ethylpropanamide
CID 65051480
ethyl 2-[1-(aminomethyl)-4-propylcyclohexyl]oxypropanoate
CID 65052370
ethyl 2-[1-(aminomethyl)-4-ethylcyclohexyl]oxybutanoate
CID 65052800
2-[4-(aminomethyl)oxan-4-yl]oxy-N-propylpropanamide
CID 65051383
[1-(aminomethyl)-4-ethylcyclohexyl] acetate
CID 151244439
2-[1-(aminomethyl)-3-methylcyclohexyl]oxy-N-butylpropanamide
CID 65052926
2-[1-(aminomethyl)-4-propan-2-ylcyclohexyl]oxypropanamide
CID 65052713
2-[1-(aminomethyl)-4-propylcyclohexyl]oxy-1-pyrrolidin-1-ylpropan-1-one
CID 65052853

Frequently Asked Questions

What is the IUPAC name of 2-[1-(aminomethyl)-4-ethylcyclohexyl]oxy-N-(2-methoxyethyl)propanamide?
The IUPAC name of 2-[1-(aminomethyl)-4-ethylcyclohexyl]oxy-N-(2-methoxyethyl)propanamide (CID 65052742) is 2-[1-(aminomethyl)-4-ethylcyclohexyl]oxy-N-(2-methoxyethyl)propanamide.
What is the SMILES notation for 2-[1-(aminomethyl)-4-ethylcyclohexyl]oxy-N-(2-methoxyethyl)propanamide?
The canonical SMILES for 2-[1-(aminomethyl)-4-ethylcyclohexyl]oxy-N-(2-methoxyethyl)propanamide is CCC1CCC(CN)(OC(C)C(=O)NCCOC)CC1.
What is the InChIKey of 2-[1-(aminomethyl)-4-ethylcyclohexyl]oxy-N-(2-methoxyethyl)propanamide?
The InChIKey is GUGQTDSLOWYYCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O3/c1-4-13-5-7-15(11-16,8-6-13)20-12(2)14(18)17-9-10-19-3/h12-13H,4-11,16H2,1-3H3,(H,17,18).
What are the key properties of 2-[1-(aminomethyl)-4-ethylcyclohexyl]oxy-N-(2-methoxyethyl)propanamide?
2-[1-(aminomethyl)-4-ethylcyclohexyl]oxy-N-(2-methoxyethyl)propanamide has a molecular weight of 286.42 g/mol, XLogP of 1.45, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(aminomethyl)-4-ethylcyclohexyl]oxy-N-(2-methoxyethyl)propanamide is sourced from PubChem (CID 65052742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).