N-[2-[2-(2-formamidoethoxy)ethoxy]ethyl]pentanamide

C12H24N2O4 — CID 20721382

IUPACN-[2-[2-(2-formamidoethoxy)ethoxy]ethyl]pentanamide
SMILESCCCCC(=O)NCCOCCOCCNC=O
InChIInChI=1S/C12H24N2O4/c1-2-3-4-12(16)14-6-8-18-10-9-17-7-5-13-11-15/h11H,2-10H2,1H3,(H,13,15)(H,14,16)
InChIKeyPRFGLHGOXYKXFF-UHFFFAOYSA-N
MW260.33 g/mol
LogP0.07
Rot. Bonds13

About N-[2-[2-(2-formamidoethoxy)ethoxy]ethyl]pentanamide

N-[2-[2-(2-formamidoethoxy)ethoxy]ethyl]pentanamide (PubChem CID 20721382) has the molecular formula C12H24N2O4 and a molecular weight of 260.33 g/mol. Its IUPAC name is N-[2-[2-(2-formamidoethoxy)ethoxy]ethyl]pentanamide.

Molecular Properties

Compound NameN-[2-[2-(2-formamidoethoxy)ethoxy]ethyl]pentanamide
PubChem CID20721382
Molecular FormulaC12H24N2O4
Molecular Weight260.33 g/mol
Exact Mass260.17
IUPAC NameN-[2-[2-(2-formamidoethoxy)ethoxy]ethyl]pentanamide
SMILESCCCCC(=O)NCCOCCOCCNC=O
InChIInChI=1S/C12H24N2O4/c1-2-3-4-12(16)14-6-8-18-10-9-17-7-5-13-11-15/h11H,2-10H2,1H3,(H,13,15)(H,14,16)
InChIKeyPRFGLHGOXYKXFF-UHFFFAOYSA-N
XLogP0.07
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.33
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(2-formamidoethoxy)ethoxy]ethyl]pentanamide?
The IUPAC name of N-[2-[2-(2-formamidoethoxy)ethoxy]ethyl]pentanamide (CID 20721382) is N-[2-[2-(2-formamidoethoxy)ethoxy]ethyl]pentanamide.
What is the SMILES notation for N-[2-[2-(2-formamidoethoxy)ethoxy]ethyl]pentanamide?
The canonical SMILES for N-[2-[2-(2-formamidoethoxy)ethoxy]ethyl]pentanamide is CCCCC(=O)NCCOCCOCCNC=O.
What is the InChIKey of N-[2-[2-(2-formamidoethoxy)ethoxy]ethyl]pentanamide?
The InChIKey is PRFGLHGOXYKXFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O4/c1-2-3-4-12(16)14-6-8-18-10-9-17-7-5-13-11-15/h11H,2-10H2,1H3,(H,13,15)(H,14,16).
What are the key properties of N-[2-[2-(2-formamidoethoxy)ethoxy]ethyl]pentanamide?
N-[2-[2-(2-formamidoethoxy)ethoxy]ethyl]pentanamide has a molecular weight of 260.33 g/mol, XLogP of 0.07, 13 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(2-formamidoethoxy)ethoxy]ethyl]pentanamide is sourced from PubChem (CID 20721382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).