5-acetamido-N-ethylpentanamide

C9H18N2O2 — CID 145189248

IUPAC5-acetamido-N-ethylpentanamide
SMILESCCNC(=O)CCCCNC(C)=O
InChIInChI=1S/C9H18N2O2/c1-3-10-9(13)6-4-5-7-11-8(2)12/h3-7H2,1-2H3,(H,10,13)(H,11,12)
InChIKeyBMOXKUDPESVVQS-UHFFFAOYSA-N
MW186.25 g/mol
LogP0.43
Rot. Bonds6

About 5-acetamido-N-ethylpentanamide

5-acetamido-N-ethylpentanamide (PubChem CID 145189248) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is 5-acetamido-N-ethylpentanamide.

Molecular Properties

Compound Name5-acetamido-N-ethylpentanamide
PubChem CID145189248
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC Name5-acetamido-N-ethylpentanamide
SMILESCCNC(=O)CCCCNC(C)=O
InChIInChI=1S/C9H18N2O2/c1-3-10-9(13)6-4-5-7-11-8(2)12/h3-7H2,1-2H3,(H,10,13)(H,11,12)
InChIKeyBMOXKUDPESVVQS-UHFFFAOYSA-N
XLogP0.43
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 50.43
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

5-acetamido-N-butylpentanamide
CID 123729472
6-acetamido-N-propylhexanamide
CID 60654879
N,N'-diethylnonanediamide
CID 89048639
N-(4-acetamidobutyl)butanamide
CID 110417477
6-[6-(6-acetamidohexanoylamino)hexanoylamino]hexanoic acid
CID 59079185
4-acetamido-N-[4-oxo-4-[[4-oxo-4-[[4-oxo-4-(propylamino)butyl]amino]butyl]amino]butyl]butanamide
CID 71430120
6-acetamido-N-ethoxyhexanamide
CID 60717872
6-acetamido-N-(3-hydroxypentyl)hexanamide
CID 115703434
N-ethylhexadecanamide
CID 18377756
N-ethyltridecanamide
CID 23297417
N-(8-oxononyl)acetamide
CID 58114719
N-(2-acetamidoethyl)-5-hydroxypentanamide
CID 79199978

Frequently Asked Questions

What is the IUPAC name of 5-acetamido-N-ethylpentanamide?
The IUPAC name of 5-acetamido-N-ethylpentanamide (CID 145189248) is 5-acetamido-N-ethylpentanamide.
What is the SMILES notation for 5-acetamido-N-ethylpentanamide?
The canonical SMILES for 5-acetamido-N-ethylpentanamide is CCNC(=O)CCCCNC(C)=O.
What is the InChIKey of 5-acetamido-N-ethylpentanamide?
The InChIKey is BMOXKUDPESVVQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-3-10-9(13)6-4-5-7-11-8(2)12/h3-7H2,1-2H3,(H,10,13)(H,11,12).
What are the key properties of 5-acetamido-N-ethylpentanamide?
5-acetamido-N-ethylpentanamide has a molecular weight of 186.25 g/mol, XLogP of 0.43, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-acetamido-N-ethylpentanamide is sourced from PubChem (CID 145189248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).