2-amino-N-(2-cyclohexyloxyethyl)-2-(oxan-4-yl)acetamide;hydrochloride

C15H29ClN2O3 — CID 120789515

IUPAC2-amino-N-(2-cyclohexyloxyethyl)-2-(oxan-4-yl)acetamide;hydrochloride
SMILESCl.NC(C(=O)NCCOC1CCCCC1)C1CCOCC1
InChIInChI=1S/C15H28N2O3.ClH/c16-14(12-6-9-19-10-7-12)15(18)17-8-11-20-13-4-2-1-3-5-13;/h12-14H,1-11,16H2,(H,17,18);1H
InChIKeyDJLZFBUQNOGRGF-UHFFFAOYSA-N
MW320.86 g/mol
LogP1.63
Rot. Bonds6

About 2-amino-N-(2-cyclohexyloxyethyl)-2-(oxan-4-yl)acetamide;hydrochloride

2-amino-N-(2-cyclohexyloxyethyl)-2-(oxan-4-yl)acetamide;hydrochloride (PubChem CID 120789515) has the molecular formula C15H29ClN2O3 and a molecular weight of 320.86 g/mol. Its IUPAC name is 2-amino-N-(2-cyclohexyloxyethyl)-2-(oxan-4-yl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-(2-cyclohexyloxyethyl)-2-(oxan-4-yl)acetamide;hydrochloride
PubChem CID120789515
Molecular FormulaC15H29ClN2O3
Molecular Weight320.86 g/mol
Exact Mass320.19
IUPAC Name2-amino-N-(2-cyclohexyloxyethyl)-2-(oxan-4-yl)acetamide;hydrochloride
SMILESCl.NC(C(=O)NCCOC1CCCCC1)C1CCOCC1
InChIInChI=1S/C15H28N2O3.ClH/c16-14(12-6-9-19-10-7-12)15(18)17-8-11-20-13-4-2-1-3-5-13;/h12-14H,1-11,16H2,(H,17,18);1H
InChIKeyDJLZFBUQNOGRGF-UHFFFAOYSA-N
XLogP1.63
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.86
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-[2-(2-methylcyclohexyl)oxyethyl]-2-(oxan-4-yl)acetamide
CID 120787402
2-amino-N-(2-cyclohexylethyl)-2-(oxan-4-yl)acetamide;hydrochloride
CID 120787635
(2R)-2-amino-N-(2-cycloheptyloxyethyl)propanamide;hydrochloride
CID 119325372
2-amino-2-(oxan-4-yl)-N-propylacetamide
CID 120783160
2-amino-N-[2-[(2-cyclohexylacetyl)amino]ethyl]-2-(oxan-4-yl)acetamide
CID 120791442
2-amino-N-(2-cyclopentyloxyethyl)-3-methylbutanamide
CID 63828819
2-amino-N-[2-[2-methoxyethyl(methyl)amino]ethyl]-2-(oxan-4-yl)acetamide;dihydrochloride
CID 120799495
2-amino-N-cyclooctyl-2-(oxan-4-yl)acetamide;hydrochloride
CID 120783011
(2R)-2-amino-N-(2-cyclohexyloxyethyl)pentanamide
CID 98582827
2-amino-N-(3-methoxy-2-methylpropyl)-2-(oxan-4-yl)acetamide;hydrochloride
CID 120790079
2-amino-N-(2-cyclopentyloxyethyl)-3,3-dimethylbutanamide
CID 77009240
2-amino-N-[2-(4-fluorophenoxy)ethyl]-2-(oxan-4-yl)acetamide;hydrochloride
CID 120787041

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-cyclohexyloxyethyl)-2-(oxan-4-yl)acetamide;hydrochloride?
The IUPAC name of 2-amino-N-(2-cyclohexyloxyethyl)-2-(oxan-4-yl)acetamide;hydrochloride (CID 120789515) is 2-amino-N-(2-cyclohexyloxyethyl)-2-(oxan-4-yl)acetamide;hydrochloride.
What is the SMILES notation for 2-amino-N-(2-cyclohexyloxyethyl)-2-(oxan-4-yl)acetamide;hydrochloride?
The canonical SMILES for 2-amino-N-(2-cyclohexyloxyethyl)-2-(oxan-4-yl)acetamide;hydrochloride is Cl.NC(C(=O)NCCOC1CCCCC1)C1CCOCC1.
What is the InChIKey of 2-amino-N-(2-cyclohexyloxyethyl)-2-(oxan-4-yl)acetamide;hydrochloride?
The InChIKey is DJLZFBUQNOGRGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O3.ClH/c16-14(12-6-9-19-10-7-12)15(18)17-8-11-20-13-4-2-1-3-5-13;/h12-14H,1-11,16H2,(H,17,18);1H.
What are the key properties of 2-amino-N-(2-cyclohexyloxyethyl)-2-(oxan-4-yl)acetamide;hydrochloride?
2-amino-N-(2-cyclohexyloxyethyl)-2-(oxan-4-yl)acetamide;hydrochloride has a molecular weight of 320.86 g/mol, XLogP of 1.63, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-cyclohexyloxyethyl)-2-(oxan-4-yl)acetamide;hydrochloride is sourced from PubChem (CID 120789515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).