2-[1-(aminomethyl)-4-propylcyclohexyl]oxy-N,N-diethylacetamide

C16H32N2O2 — CID 65052460

IUPAC2-[1-(aminomethyl)-4-propylcyclohexyl]oxy-N,N-diethylacetamide
SMILESCCCC1CCC(CN)(OCC(=O)N(CC)CC)CC1
InChIInChI=1S/C16H32N2O2/c1-4-7-14-8-10-16(13-17,11-9-14)20-12-15(19)18(5-2)6-3/h14H,4-13,17H2,1-3H3
InChIKeyGXKIYEKNHOOCRI-UHFFFAOYSA-N
MW284.44 g/mol
LogP2.56
Rot. Bonds8

About 2-[1-(aminomethyl)-4-propylcyclohexyl]oxy-N,N-diethylacetamide

2-[1-(aminomethyl)-4-propylcyclohexyl]oxy-N,N-diethylacetamide (PubChem CID 65052460) has the molecular formula C16H32N2O2 and a molecular weight of 284.44 g/mol. Its IUPAC name is 2-[1-(aminomethyl)-4-propylcyclohexyl]oxy-N,N-diethylacetamide.

Molecular Properties

Compound Name2-[1-(aminomethyl)-4-propylcyclohexyl]oxy-N,N-diethylacetamide
PubChem CID65052460
Molecular FormulaC16H32N2O2
Molecular Weight284.44 g/mol
Exact Mass284.25
IUPAC Name2-[1-(aminomethyl)-4-propylcyclohexyl]oxy-N,N-diethylacetamide
SMILESCCCC1CCC(CN)(OCC(=O)N(CC)CC)CC1
InChIInChI=1S/C16H32N2O2/c1-4-7-14-8-10-16(13-17,11-9-14)20-12-15(19)18(5-2)6-3/h14H,4-13,17H2,1-3H3
InChIKeyGXKIYEKNHOOCRI-UHFFFAOYSA-N
XLogP2.56
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.44
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[1-(aminomethyl)-4-propylcyclohexyl]oxy-N,N-diethylacetamide 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-propylcyclohexyl]oxy-N-pentan-3-ylacetamide
CID 65052321
2-[1-(aminomethyl)-4-propylcyclohexyl]oxy-N-(2,2,2-trifluoroethyl)acetamide
CID 65052464
2-[1-(aminomethyl)-4-propylcyclohexyl]oxy-1-morpholin-4-ylethanone
CID 65052366
ethyl 2-[1-(aminomethyl)-4-propylcyclohexyl]oxypropanoate
CID 65052370
[4-propyl-1-(2,2,2-trifluoroethoxy)cyclohexyl]methanamine
CID 55036534
(1-methoxy-4-propylcyclohexyl)methanamine
CID 62107282
2-[1-(aminomethyl)-3-methylcyclopentyl]oxy-N-ethyl-N-methylacetamide
CID 65051568
[1-(4-methoxybutoxy)-4-propylcyclohexyl]methanamine
CID 113436771
(1-ethoxy-4-propylcyclohexyl)methanol
CID 165489983
(1-methoxy-4-propylcycloheptyl)methanamine
CID 66073417
2-[1-(aminomethyl)-4,4-dimethylcyclohexyl]oxy-N-cyclopropyl-N-methylacetamide
CID 65050897
[1-(oxolan-3-ylmethoxy)-4-propylcyclohexyl]methanamine
CID 55036245

Frequently Asked Questions

What is the IUPAC name of 2-[1-(aminomethyl)-4-propylcyclohexyl]oxy-N,N-diethylacetamide?
The IUPAC name of 2-[1-(aminomethyl)-4-propylcyclohexyl]oxy-N,N-diethylacetamide (CID 65052460) is 2-[1-(aminomethyl)-4-propylcyclohexyl]oxy-N,N-diethylacetamide.
What is the SMILES notation for 2-[1-(aminomethyl)-4-propylcyclohexyl]oxy-N,N-diethylacetamide?
The canonical SMILES for 2-[1-(aminomethyl)-4-propylcyclohexyl]oxy-N,N-diethylacetamide is CCCC1CCC(CN)(OCC(=O)N(CC)CC)CC1.
What is the InChIKey of 2-[1-(aminomethyl)-4-propylcyclohexyl]oxy-N,N-diethylacetamide?
The InChIKey is GXKIYEKNHOOCRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O2/c1-4-7-14-8-10-16(13-17,11-9-14)20-12-15(19)18(5-2)6-3/h14H,4-13,17H2,1-3H3.
What are the key properties of 2-[1-(aminomethyl)-4-propylcyclohexyl]oxy-N,N-diethylacetamide?
2-[1-(aminomethyl)-4-propylcyclohexyl]oxy-N,N-diethylacetamide has a molecular weight of 284.44 g/mol, XLogP of 2.56, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(aminomethyl)-4-propylcyclohexyl]oxy-N,N-diethylacetamide is sourced from PubChem (CID 65052460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).