di(imidazolidin-4-yl)methanone

C7H14N4O — CID 174675876

IUPACdi(imidazolidin-4-yl)methanone
SMILESO=C(C1CNCN1)C1CNCN1
InChIInChI=1S/C7H14N4O/c12-7(5-1-8-3-10-5)6-2-9-4-11-6/h5-6,8-11H,1-4H2
InChIKeyAZDYLWBBBQZLJK-UHFFFAOYSA-N
MW170.22 g/mol
LogP-2.41
Rot. Bonds2

About di(imidazolidin-4-yl)methanone

di(imidazolidin-4-yl)methanone (PubChem CID 174675876) has the molecular formula C7H14N4O and a molecular weight of 170.22 g/mol. Its IUPAC name is di(imidazolidin-4-yl)methanone.

Molecular Properties

Compound Namedi(imidazolidin-4-yl)methanone
PubChem CID174675876
Molecular FormulaC7H14N4O
Molecular Weight170.22 g/mol
Exact Mass170.12
IUPAC Namedi(imidazolidin-4-yl)methanone
SMILESO=C(C1CNCN1)C1CNCN1
InChIInChI=1S/C7H14N4O/c12-7(5-1-8-3-10-5)6-2-9-4-11-6/h5-6,8-11H,1-4H2
InChIKeyAZDYLWBBBQZLJK-UHFFFAOYSA-N
XLogP-2.41
TPSA65.19 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.22
LogP ≤ 5-2.41
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of di(imidazolidin-4-yl)methanone?
The IUPAC name of di(imidazolidin-4-yl)methanone (CID 174675876) is di(imidazolidin-4-yl)methanone.
What is the SMILES notation for di(imidazolidin-4-yl)methanone?
The canonical SMILES for di(imidazolidin-4-yl)methanone is O=C(C1CNCN1)C1CNCN1.
What is the InChIKey of di(imidazolidin-4-yl)methanone?
The InChIKey is AZDYLWBBBQZLJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N4O/c12-7(5-1-8-3-10-5)6-2-9-4-11-6/h5-6,8-11H,1-4H2.
What are the key properties of di(imidazolidin-4-yl)methanone?
di(imidazolidin-4-yl)methanone has a molecular weight of 170.22 g/mol, XLogP of -2.41, 2 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for di(imidazolidin-4-yl)methanone is sourced from PubChem (CID 174675876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).