2-amino-5-oxohexanamide

C6H12N2O2 — CID 4606265

IUPAC2-amino-5-oxohexanamide
SMILESCC(=O)CCC(N)C(N)=O
InChIInChI=1S/C6H12N2O2/c1-4(9)2-3-5(7)6(8)10/h5H,2-3,7H2,1H3,(H2,8,10)
InChIKeyAULUINXDLCVMOX-UHFFFAOYSA-N
MW144.17 g/mol
LogP-0.83
Rot. Bonds4

About 2-amino-5-oxohexanamide

2-amino-5-oxohexanamide (PubChem CID 4606265) has the molecular formula C6H12N2O2 and a molecular weight of 144.17 g/mol. Its IUPAC name is 2-amino-5-oxohexanamide.

Molecular Properties

Compound Name2-amino-5-oxohexanamide
PubChem CID4606265
Molecular FormulaC6H12N2O2
Molecular Weight144.17 g/mol
Exact Mass144.09
IUPAC Name2-amino-5-oxohexanamide
SMILESCC(=O)CCC(N)C(N)=O
InChIInChI=1S/C6H12N2O2/c1-4(9)2-3-5(7)6(8)10/h5H,2-3,7H2,1H3,(H2,8,10)
InChIKeyAULUINXDLCVMOX-UHFFFAOYSA-N
XLogP-0.83
TPSA86.18 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.17
LogP ≤ 5-0.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-5-oxohexanamide?
The IUPAC name of 2-amino-5-oxohexanamide (CID 4606265) is 2-amino-5-oxohexanamide.
What is the SMILES notation for 2-amino-5-oxohexanamide?
The canonical SMILES for 2-amino-5-oxohexanamide is CC(=O)CCC(N)C(N)=O.
What is the InChIKey of 2-amino-5-oxohexanamide?
The InChIKey is AULUINXDLCVMOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O2/c1-4(9)2-3-5(7)6(8)10/h5H,2-3,7H2,1H3,(H2,8,10).
What are the key properties of 2-amino-5-oxohexanamide?
2-amino-5-oxohexanamide has a molecular weight of 144.17 g/mol, XLogP of -0.83, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-oxohexanamide is sourced from PubChem (CID 4606265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).