N-(4-methoxyphenyl)-2-(2-propan-2-yloxyethylamino)acetamide

C14H22N2O3 — CID 104760150

IUPACN-(4-methoxyphenyl)-2-(2-propan-2-yloxyethylamino)acetamide
SMILESCOc1ccc(NC(=O)CNCCOC(C)C)cc1
InChIInChI=1S/C14H22N2O3/c1-11(2)19-9-8-15-10-14(17)16-12-4-6-13(18-3)7-5-12/h4-7,11,15H,8-10H2,1-3H3,(H,16,17)
InChIKeyLWZUCBZQONMRIO-UHFFFAOYSA-N
MW266.34 g/mol
LogP1.65
Rot. Bonds8

About N-(4-methoxyphenyl)-2-(2-propan-2-yloxyethylamino)acetamide

N-(4-methoxyphenyl)-2-(2-propan-2-yloxyethylamino)acetamide (PubChem CID 104760150) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-2-(2-propan-2-yloxyethylamino)acetamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-2-(2-propan-2-yloxyethylamino)acetamide
PubChem CID104760150
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC NameN-(4-methoxyphenyl)-2-(2-propan-2-yloxyethylamino)acetamide
SMILESCOc1ccc(NC(=O)CNCCOC(C)C)cc1
InChIInChI=1S/C14H22N2O3/c1-11(2)19-9-8-15-10-14(17)16-12-4-6-13(18-3)7-5-12/h4-7,11,15H,8-10H2,1-3H3,(H,16,17)
InChIKeyLWZUCBZQONMRIO-UHFFFAOYSA-N
XLogP1.65
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 51.65
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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Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-2-(2-propan-2-yloxyethylamino)acetamide?
The IUPAC name of N-(4-methoxyphenyl)-2-(2-propan-2-yloxyethylamino)acetamide (CID 104760150) is N-(4-methoxyphenyl)-2-(2-propan-2-yloxyethylamino)acetamide.
What is the SMILES notation for N-(4-methoxyphenyl)-2-(2-propan-2-yloxyethylamino)acetamide?
The canonical SMILES for N-(4-methoxyphenyl)-2-(2-propan-2-yloxyethylamino)acetamide is COc1ccc(NC(=O)CNCCOC(C)C)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-2-(2-propan-2-yloxyethylamino)acetamide?
The InChIKey is LWZUCBZQONMRIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-11(2)19-9-8-15-10-14(17)16-12-4-6-13(18-3)7-5-12/h4-7,11,15H,8-10H2,1-3H3,(H,16,17).
What are the key properties of N-(4-methoxyphenyl)-2-(2-propan-2-yloxyethylamino)acetamide?
N-(4-methoxyphenyl)-2-(2-propan-2-yloxyethylamino)acetamide has a molecular weight of 266.34 g/mol, XLogP of 1.65, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-2-(2-propan-2-yloxyethylamino)acetamide is sourced from PubChem (CID 104760150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).