N-heptyl-2-(2-methoxyphenyl)acetamide

C16H25NO2 — CID 3375995

IUPACN-heptyl-2-(2-methoxyphenyl)acetamide
SMILESCCCCCCCNC(=O)Cc1ccccc1OC
InChIInChI=1S/C16H25NO2/c1-3-4-5-6-9-12-17-16(18)13-14-10-7-8-11-15(14)19-2/h7-8,10-11H,3-6,9,12-13H2,1-2H3,(H,17,18)
InChIKeyOJROIEWDUWDOOG-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.32
Rot. Bonds9

About N-heptyl-2-(2-methoxyphenyl)acetamide

N-heptyl-2-(2-methoxyphenyl)acetamide (PubChem CID 3375995) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is N-heptyl-2-(2-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-heptyl-2-(2-methoxyphenyl)acetamide
PubChem CID3375995
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC NameN-heptyl-2-(2-methoxyphenyl)acetamide
SMILESCCCCCCCNC(=O)Cc1ccccc1OC
InChIInChI=1S/C16H25NO2/c1-3-4-5-6-9-12-17-16(18)13-14-10-7-8-11-15(14)19-2/h7-8,10-11H,3-6,9,12-13H2,1-2H3,(H,17,18)
InChIKeyOJROIEWDUWDOOG-UHFFFAOYSA-N
XLogP3.32
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-hexyl-3-[(2-methoxyphenyl)methyl]urea
CID 30694177
N'-[(2-methoxyphenyl)methyl]-N-pentyloxamide
CID 44902500
N-(4-cyanobutyl)-2-(2-methoxyphenyl)acetamide
CID 63284741
N-(2-hydroxyethyl)-2-(2-methoxyphenyl)acetamide
CID 43388864
N-hexyl-2-(2-methoxyphenoxy)acetamide
CID 19169780
N-ethyl-2-(2-methoxyphenyl)acetamide
CID 3376729
2-methoxy-N-tridecylbenzamide
CID 139819873
N-[(2-methoxyphenyl)methyl]hexan-1-amine
CID 4716798
2-(2-methoxyphenyl)-N-(3-phenylsulfanylpropyl)acetamide
CID 38567183
2-(5-acetyl-2-methoxyphenyl)-N-pentylacetamide
CID 78791662
2-[2-(octylamino)-2-oxoethyl]benzoic acid
CID 104601721
2-naphthalen-1-yl-N-octadecylacetamide
CID 71334923

Frequently Asked Questions

What is the IUPAC name of N-heptyl-2-(2-methoxyphenyl)acetamide?
The IUPAC name of N-heptyl-2-(2-methoxyphenyl)acetamide (CID 3375995) is N-heptyl-2-(2-methoxyphenyl)acetamide.
What is the SMILES notation for N-heptyl-2-(2-methoxyphenyl)acetamide?
The canonical SMILES for N-heptyl-2-(2-methoxyphenyl)acetamide is CCCCCCCNC(=O)Cc1ccccc1OC.
What is the InChIKey of N-heptyl-2-(2-methoxyphenyl)acetamide?
The InChIKey is OJROIEWDUWDOOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-3-4-5-6-9-12-17-16(18)13-14-10-7-8-11-15(14)19-2/h7-8,10-11H,3-6,9,12-13H2,1-2H3,(H,17,18).
What are the key properties of N-heptyl-2-(2-methoxyphenyl)acetamide?
N-heptyl-2-(2-methoxyphenyl)acetamide has a molecular weight of 263.38 g/mol, XLogP of 3.32, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-heptyl-2-(2-methoxyphenyl)acetamide is sourced from PubChem (CID 3375995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).