2-amino-N-(3-cyclohexyloxypropyl)-2-(4-methylphenyl)acetamide

C18H28N2O2 — CID 120666811

IUPAC2-amino-N-(3-cyclohexyloxypropyl)-2-(4-methylphenyl)acetamide
SMILESCc1ccc(C(N)C(=O)NCCCOC2CCCCC2)cc1
InChIInChI=1S/C18H28N2O2/c1-14-8-10-15(11-9-14)17(19)18(21)20-12-5-13-22-16-6-3-2-4-7-16/h8-11,16-17H,2-7,12-13,19H2,1H3,(H,20,21)
InChIKeyIQPQKNXVGJBTHY-UHFFFAOYSA-N
MW304.43 g/mol
LogP2.85
Rot. Bonds7

About 2-amino-N-(3-cyclohexyloxypropyl)-2-(4-methylphenyl)acetamide

2-amino-N-(3-cyclohexyloxypropyl)-2-(4-methylphenyl)acetamide (PubChem CID 120666811) has the molecular formula C18H28N2O2 and a molecular weight of 304.43 g/mol. Its IUPAC name is 2-amino-N-(3-cyclohexyloxypropyl)-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-amino-N-(3-cyclohexyloxypropyl)-2-(4-methylphenyl)acetamide
PubChem CID120666811
Molecular FormulaC18H28N2O2
Molecular Weight304.43 g/mol
Exact Mass304.22
IUPAC Name2-amino-N-(3-cyclohexyloxypropyl)-2-(4-methylphenyl)acetamide
SMILESCc1ccc(C(N)C(=O)NCCCOC2CCCCC2)cc1
InChIInChI=1S/C18H28N2O2/c1-14-8-10-15(11-9-14)17(19)18(21)20-12-5-13-22-16-6-3-2-4-7-16/h8-11,16-17H,2-7,12-13,19H2,1H3,(H,20,21)
InChIKeyIQPQKNXVGJBTHY-UHFFFAOYSA-N
XLogP2.85
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.43
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-amino-2-(4-methylphenyl)-N-[3-(oxan-4-yloxy)propyl]acetamide
CID 120668843
2-amino-N-(2-cycloheptyloxyethyl)-2-phenylacetamide;hydrochloride
CID 119325370
2-amino-N-[3-(cyclopropylmethoxy)propyl]-2-(4-methylphenyl)acetamide
CID 106151199
2-amino-2-(4-methylphenyl)-N-[3-(2-methylpropoxy)propyl]acetamide
CID 106151202
2-amino-N-(3-cyclohexyloxypropyl)propanamide
CID 61275790
N-(3-cyclohexyloxypropyl)-2-(4-methylphenoxy)acetamide
CID 134030025
3-[[2-amino-2-(4-methylphenyl)acetyl]amino]-N-cyclohexylpropanamide
CID 120667696
2-amino-N-[2-[(2-cyclohexylacetyl)amino]ethyl]-2-(4-methylphenyl)acetamide;hydrochloride
CID 120668147
N-(3-cyclohexyloxypropyl)-4-propan-2-ylbenzamide
CID 134029978
N-(3-cyclohexyloxypropyl)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanamide
CID 46613224
2-amino-2-(4-methylphenyl)-N-[3-(2-methylpiperidin-1-yl)propyl]acetamide
CID 120669404
4-[[2-amino-2-(4-methylphenyl)acetyl]amino]-N-cyclopropylbutanamide
CID 106151335

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-cyclohexyloxypropyl)-2-(4-methylphenyl)acetamide?
The IUPAC name of 2-amino-N-(3-cyclohexyloxypropyl)-2-(4-methylphenyl)acetamide (CID 120666811) is 2-amino-N-(3-cyclohexyloxypropyl)-2-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-amino-N-(3-cyclohexyloxypropyl)-2-(4-methylphenyl)acetamide?
The canonical SMILES for 2-amino-N-(3-cyclohexyloxypropyl)-2-(4-methylphenyl)acetamide is Cc1ccc(C(N)C(=O)NCCCOC2CCCCC2)cc1.
What is the InChIKey of 2-amino-N-(3-cyclohexyloxypropyl)-2-(4-methylphenyl)acetamide?
The InChIKey is IQPQKNXVGJBTHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O2/c1-14-8-10-15(11-9-14)17(19)18(21)20-12-5-13-22-16-6-3-2-4-7-16/h8-11,16-17H,2-7,12-13,19H2,1H3,(H,20,21).
What are the key properties of 2-amino-N-(3-cyclohexyloxypropyl)-2-(4-methylphenyl)acetamide?
2-amino-N-(3-cyclohexyloxypropyl)-2-(4-methylphenyl)acetamide has a molecular weight of 304.43 g/mol, XLogP of 2.85, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-cyclohexyloxypropyl)-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 120666811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).