N,N'-bis(2-aminopropyl)oxamide

C8H18N4O2 — CID 15303796

IUPACN,N'-bis(2-aminopropyl)oxamide
SMILESCC(N)CNC(=O)C(=O)NCC(C)N
InChIInChI=1S/C8H18N4O2/c1-5(9)3-11-7(13)8(14)12-4-6(2)10/h5-6H,3-4,9-10H2,1-2H3,(H,11,13)(H,12,14)
InChIKeyVVNQOBPVAVMTLF-UHFFFAOYSA-N
MW202.26 g/mol
LogP-2.09
Rot. Bonds4

About N,N'-bis(2-aminopropyl)oxamide

N,N'-bis(2-aminopropyl)oxamide (PubChem CID 15303796) has the molecular formula C8H18N4O2 and a molecular weight of 202.26 g/mol. Its IUPAC name is N,N'-bis(2-aminopropyl)oxamide.

Molecular Properties

Compound NameN,N'-bis(2-aminopropyl)oxamide
PubChem CID15303796
Molecular FormulaC8H18N4O2
Molecular Weight202.26 g/mol
Exact Mass202.14
IUPAC NameN,N'-bis(2-aminopropyl)oxamide
SMILESCC(N)CNC(=O)C(=O)NCC(C)N
InChIInChI=1S/C8H18N4O2/c1-5(9)3-11-7(13)8(14)12-4-6(2)10/h5-6H,3-4,9-10H2,1-2H3,(H,11,13)(H,12,14)
InChIKeyVVNQOBPVAVMTLF-UHFFFAOYSA-N
XLogP-2.09
TPSA110.24 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 5-2.09
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N'-bis(2-aminopropyl)oxamide?
The IUPAC name of N,N'-bis(2-aminopropyl)oxamide (CID 15303796) is N,N'-bis(2-aminopropyl)oxamide.
What is the SMILES notation for N,N'-bis(2-aminopropyl)oxamide?
The canonical SMILES for N,N'-bis(2-aminopropyl)oxamide is CC(N)CNC(=O)C(=O)NCC(C)N.
What is the InChIKey of N,N'-bis(2-aminopropyl)oxamide?
The InChIKey is VVNQOBPVAVMTLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N4O2/c1-5(9)3-11-7(13)8(14)12-4-6(2)10/h5-6H,3-4,9-10H2,1-2H3,(H,11,13)(H,12,14).
What are the key properties of N,N'-bis(2-aminopropyl)oxamide?
N,N'-bis(2-aminopropyl)oxamide has a molecular weight of 202.26 g/mol, XLogP of -2.09, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-bis(2-aminopropyl)oxamide is sourced from PubChem (CID 15303796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).