2-[2-(4-pentylphenoxy)ethylamino]acetamide

C15H24N2O2 — CID 58097092

IUPAC2-[2-(4-pentylphenoxy)ethylamino]acetamide
SMILESCCCCCc1ccc(OCCNCC(N)=O)cc1
InChIInChI=1S/C15H24N2O2/c1-2-3-4-5-13-6-8-14(9-7-13)19-11-10-17-12-15(16)18/h6-9,17H,2-5,10-12H2,1H3,(H2,16,18)
InChIKeyCRELUXNYQQXIMK-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.87
Rot. Bonds10

About 2-[2-(4-pentylphenoxy)ethylamino]acetamide

2-[2-(4-pentylphenoxy)ethylamino]acetamide (PubChem CID 58097092) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-[2-(4-pentylphenoxy)ethylamino]acetamide.

Molecular Properties

Compound Name2-[2-(4-pentylphenoxy)ethylamino]acetamide
PubChem CID58097092
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name2-[2-(4-pentylphenoxy)ethylamino]acetamide
SMILESCCCCCc1ccc(OCCNCC(N)=O)cc1
InChIInChI=1S/C15H24N2O2/c1-2-3-4-5-13-6-8-14(9-7-13)19-11-10-17-12-15(16)18/h6-9,17H,2-5,10-12H2,1H3,(H2,16,18)
InChIKeyCRELUXNYQQXIMK-UHFFFAOYSA-N
XLogP1.87
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.87
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-(4-nonylphenoxy)acetamide
CID 54388059
N-[2-[2-[2-[2-[2-(4-butylphenoxy)ethylamino]ethylamino]ethylamino]ethylamino]ethyl]acetamide
CID 71342969
N-[2-(4-propylphenoxy)ethyl]pentan-1-amine
CID 63515764
3-[(4-pentoxyphenyl)methylamino]propanamide
CID 43553209
1-hexoxy-4-pentylbenzene
CID 54277450
N-[2-(4-nonylphenoxy)ethyl]prop-2-enamide
CID 134245011
N-[2-(4-butylphenoxy)ethyl]-2-ethoxyethanamine
CID 115493382
2-(4-octylphenoxy)ethyl 2,2,2-tribromoacetate
CID 58711530
5-[(4-butoxyphenyl)methylamino]pentanamide
CID 106233532
2-(4-octylphenoxy)acetic acid
CID 27145
7-(4-hexylphenoxy)heptanoic acid
CID 54502336
4-(4-nonylphenoxy)butanoate
CID 22965467

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-pentylphenoxy)ethylamino]acetamide?
The IUPAC name of 2-[2-(4-pentylphenoxy)ethylamino]acetamide (CID 58097092) is 2-[2-(4-pentylphenoxy)ethylamino]acetamide.
What is the SMILES notation for 2-[2-(4-pentylphenoxy)ethylamino]acetamide?
The canonical SMILES for 2-[2-(4-pentylphenoxy)ethylamino]acetamide is CCCCCc1ccc(OCCNCC(N)=O)cc1.
What is the InChIKey of 2-[2-(4-pentylphenoxy)ethylamino]acetamide?
The InChIKey is CRELUXNYQQXIMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-2-3-4-5-13-6-8-14(9-7-13)19-11-10-17-12-15(16)18/h6-9,17H,2-5,10-12H2,1H3,(H2,16,18).
What are the key properties of 2-[2-(4-pentylphenoxy)ethylamino]acetamide?
2-[2-(4-pentylphenoxy)ethylamino]acetamide has a molecular weight of 264.37 g/mol, XLogP of 1.87, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-pentylphenoxy)ethylamino]acetamide is sourced from PubChem (CID 58097092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).