N-(5-acetamidoheptyl)acetamide

C11H22N2O2 — CID 59001684

IUPACN-(5-acetamidoheptyl)acetamide
SMILESCCC(CCCCNC(C)=O)NC(C)=O
InChIInChI=1S/C11H22N2O2/c1-4-11(13-10(3)15)7-5-6-8-12-9(2)14/h11H,4-8H2,1-3H3,(H,12,14)(H,13,15)
InChIKeySNICLDAVEBKPML-UHFFFAOYSA-N
MW214.31 g/mol
LogP1.21
Rot. Bonds7

About N-(5-acetamidoheptyl)acetamide

N-(5-acetamidoheptyl)acetamide (PubChem CID 59001684) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N-(5-acetamidoheptyl)acetamide.

Molecular Properties

Compound NameN-(5-acetamidoheptyl)acetamide
PubChem CID59001684
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN-(5-acetamidoheptyl)acetamide
SMILESCCC(CCCCNC(C)=O)NC(C)=O
InChIInChI=1S/C11H22N2O2/c1-4-11(13-10(3)15)7-5-6-8-12-9(2)14/h11H,4-8H2,1-3H3,(H,12,14)(H,13,15)
InChIKeySNICLDAVEBKPML-UHFFFAOYSA-N
XLogP1.21
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[(3S)-6-aminohexan-3-yl]acetamide
CID 143107836
10-(carboxyamino)decan-3-ylcarbamic acid
CID 175071012
N-[(2R)-2-acetamidobutyl]acetamide
CID 102008964
N-(2-acetamidobutyl)acetamide
CID 547374
2,6-diacetamidohexanoate
CID 78438708
2-amino-N-[(6R)-6-[(2-aminoacetyl)amino]octyl]acetamide
CID 160835672
N-(3-acetamidopropyl)acetamide
CID 5147555
N-pentadecan-4-ylacetamide
CID 87419548
N-pentadecylacetamide
CID 12009452
N-nonadecylacetamide
CID 54574805
N-hexylacetamide
CID 24129
ethyl 3-[[(3S)-6-acetamidohexan-3-yl]amino]propanoate
CID 125469320

Frequently Asked Questions

What is the IUPAC name of N-(5-acetamidoheptyl)acetamide?
The IUPAC name of N-(5-acetamidoheptyl)acetamide (CID 59001684) is N-(5-acetamidoheptyl)acetamide.
What is the SMILES notation for N-(5-acetamidoheptyl)acetamide?
The canonical SMILES for N-(5-acetamidoheptyl)acetamide is CCC(CCCCNC(C)=O)NC(C)=O.
What is the InChIKey of N-(5-acetamidoheptyl)acetamide?
The InChIKey is SNICLDAVEBKPML-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-4-11(13-10(3)15)7-5-6-8-12-9(2)14/h11H,4-8H2,1-3H3,(H,12,14)(H,13,15).
What are the key properties of N-(5-acetamidoheptyl)acetamide?
N-(5-acetamidoheptyl)acetamide has a molecular weight of 214.31 g/mol, XLogP of 1.21, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetamidoheptyl)acetamide is sourced from PubChem (CID 59001684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).