2-(3-cyclopropyl-5-imino-2-oxoimidazolidin-4-yl)acetamide

C8H12N4O2 — CID 138389128

IUPAC2-(3-cyclopropyl-5-imino-2-oxoimidazolidin-4-yl)acetamide
SMILES[H]/N=C1\NC(=O)N(C2CC2)C1CC(N)=O
InChIInChI=1S/C8H12N4O2/c9-6(13)3-5-7(10)11-8(14)12(5)4-1-2-4/h4-5H,1-3H2,(H2,9,13)(H2,10,11,14)
InChIKeyRAUFUPZUVCOQJY-UHFFFAOYSA-N
MW196.21 g/mol
LogP-0.60
Rot. Bonds3

About 2-(3-cyclopropyl-5-imino-2-oxoimidazolidin-4-yl)acetamide

2-(3-cyclopropyl-5-imino-2-oxoimidazolidin-4-yl)acetamide (PubChem CID 138389128) has the molecular formula C8H12N4O2 and a molecular weight of 196.21 g/mol. Its IUPAC name is 2-(3-cyclopropyl-5-imino-2-oxoimidazolidin-4-yl)acetamide.

Molecular Properties

Compound Name2-(3-cyclopropyl-5-imino-2-oxoimidazolidin-4-yl)acetamide
PubChem CID138389128
Molecular FormulaC8H12N4O2
Molecular Weight196.21 g/mol
Exact Mass196.10
IUPAC Name2-(3-cyclopropyl-5-imino-2-oxoimidazolidin-4-yl)acetamide
SMILES[H]/N=C1\NC(=O)N(C2CC2)C1CC(N)=O
InChIInChI=1S/C8H12N4O2/c9-6(13)3-5-7(10)11-8(14)12(5)4-1-2-4/h4-5H,1-3H2,(H2,9,13)(H2,10,11,14)
InChIKeyRAUFUPZUVCOQJY-UHFFFAOYSA-N
XLogP-0.60
TPSA99.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.21
LogP ≤ 5-0.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

2-(3-cyclopropyl-5-imino-2-oxoimidazolidin-4-yl)-N,N-dimethylacetamide
CID 138388382
1-cyclopropyl-4-imino-5-(2-phenylpropyl)imidazolidin-2-one
CID 138388566
2-(4-imino-2-oxo-1,3-thiazolidin-5-yl)acetamide
CID 137320894
1-cyclopropyl-5-(3,4-dimethoxyphenyl)-4-iminoimidazolidin-2-one
CID 138388842
ethyl 2-(5-imino-3-methyl-2-oxoimidazolidin-4-yl)acetate
CID 138389169
ethyl 2-(3-ethyl-5-imino-2-oxoimidazolidin-4-yl)acetate
CID 138389539
5-(2-aminoethyl)-1-cyclopropylimidazolidine-2,4-dione
CID 83876210
2-(5-imino-2-oxo-3-propan-2-ylimidazolidin-4-yl)-N-propan-2-ylacetamide
CID 138390417
N-ethyl-2-(5-imino-3-methyl-2-oxoimidazolidin-4-yl)acetamide
CID 138388887
5-(3-chloro-4-methoxyphenyl)-1-cyclopropyl-4-iminoimidazolidin-2-one
CID 138388845
2-[3-(cyclopropylmethyl)-5-imino-2-oxoimidazolidin-4-yl]-N-propylacetamide
CID 138391065
1-cyclopropyl-4-imino-5-[3-(methoxymethyl)phenyl]imidazolidin-2-one
CID 138389220

Frequently Asked Questions

What is the IUPAC name of 2-(3-cyclopropyl-5-imino-2-oxoimidazolidin-4-yl)acetamide?
The IUPAC name of 2-(3-cyclopropyl-5-imino-2-oxoimidazolidin-4-yl)acetamide (CID 138389128) is 2-(3-cyclopropyl-5-imino-2-oxoimidazolidin-4-yl)acetamide.
What is the SMILES notation for 2-(3-cyclopropyl-5-imino-2-oxoimidazolidin-4-yl)acetamide?
The canonical SMILES for 2-(3-cyclopropyl-5-imino-2-oxoimidazolidin-4-yl)acetamide is [H]/N=C1\NC(=O)N(C2CC2)C1CC(N)=O.
What is the InChIKey of 2-(3-cyclopropyl-5-imino-2-oxoimidazolidin-4-yl)acetamide?
The InChIKey is RAUFUPZUVCOQJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O2/c9-6(13)3-5-7(10)11-8(14)12(5)4-1-2-4/h4-5H,1-3H2,(H2,9,13)(H2,10,11,14).
What are the key properties of 2-(3-cyclopropyl-5-imino-2-oxoimidazolidin-4-yl)acetamide?
2-(3-cyclopropyl-5-imino-2-oxoimidazolidin-4-yl)acetamide has a molecular weight of 196.21 g/mol, XLogP of -0.60, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyclopropyl-5-imino-2-oxoimidazolidin-4-yl)acetamide is sourced from PubChem (CID 138389128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).