1-(3-amino-2,2-dimethylcyclobutyl)imidazolidin-2-one

C9H17N3O — CID 130987498

IUPAC1-(3-amino-2,2-dimethylcyclobutyl)imidazolidin-2-one
SMILESCC1(C)C(N)CC1N1CCNC1=O
InChIInChI=1S/C9H17N3O/c1-9(2)6(10)5-7(9)12-4-3-11-8(12)13/h6-7H,3-5,10H2,1-2H3,(H,11,13)
InChIKeyXMDBCFLKBLFDCY-UHFFFAOYSA-N
MW183.25 g/mol
LogP0.14
Rot. Bonds1

About 1-(3-amino-2,2-dimethylcyclobutyl)imidazolidin-2-one

1-(3-amino-2,2-dimethylcyclobutyl)imidazolidin-2-one (PubChem CID 130987498) has the molecular formula C9H17N3O and a molecular weight of 183.25 g/mol. Its IUPAC name is 1-(3-amino-2,2-dimethylcyclobutyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-(3-amino-2,2-dimethylcyclobutyl)imidazolidin-2-one
PubChem CID130987498
Molecular FormulaC9H17N3O
Molecular Weight183.25 g/mol
Exact Mass183.14
IUPAC Name1-(3-amino-2,2-dimethylcyclobutyl)imidazolidin-2-one
SMILESCC1(C)C(N)CC1N1CCNC1=O
InChIInChI=1S/C9H17N3O/c1-9(2)6(10)5-7(9)12-4-3-11-8(12)13/h6-7H,3-5,10H2,1-2H3,(H,11,13)
InChIKeyXMDBCFLKBLFDCY-UHFFFAOYSA-N
XLogP0.14
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(3-amino-2,2-dimethylcyclobutyl)imidazolidin-2-one?
The IUPAC name of 1-(3-amino-2,2-dimethylcyclobutyl)imidazolidin-2-one (CID 130987498) is 1-(3-amino-2,2-dimethylcyclobutyl)imidazolidin-2-one.
What is the SMILES notation for 1-(3-amino-2,2-dimethylcyclobutyl)imidazolidin-2-one?
The canonical SMILES for 1-(3-amino-2,2-dimethylcyclobutyl)imidazolidin-2-one is CC1(C)C(N)CC1N1CCNC1=O.
What is the InChIKey of 1-(3-amino-2,2-dimethylcyclobutyl)imidazolidin-2-one?
The InChIKey is XMDBCFLKBLFDCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O/c1-9(2)6(10)5-7(9)12-4-3-11-8(12)13/h6-7H,3-5,10H2,1-2H3,(H,11,13).
What are the key properties of 1-(3-amino-2,2-dimethylcyclobutyl)imidazolidin-2-one?
1-(3-amino-2,2-dimethylcyclobutyl)imidazolidin-2-one has a molecular weight of 183.25 g/mol, XLogP of 0.14, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-amino-2,2-dimethylcyclobutyl)imidazolidin-2-one is sourced from PubChem (CID 130987498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).