(5R)-4-amino-5-methyl-1,5-dihydroimidazol-2-one

C4H7N3O — CID 124512317

IUPAC(5R)-4-amino-5-methyl-1,5-dihydroimidazol-2-one
SMILESC[C@H]1NC(=O)N=C1N
InChIInChI=1S/C4H7N3O/c1-2-3(5)7-4(8)6-2/h2H,1H3,(H3,5,6,7,8)/t2-/m1/s1
InChIKeyHGHGYCVXQBIEEI-UWTATZPHSA-N
MW113.12 g/mol
LogP-0.54
Rot. Bonds

About (5R)-4-amino-5-methyl-1,5-dihydroimidazol-2-one

(5R)-4-amino-5-methyl-1,5-dihydroimidazol-2-one (PubChem CID 124512317) has the molecular formula C4H7N3O and a molecular weight of 113.12 g/mol. Its IUPAC name is (5R)-4-amino-5-methyl-1,5-dihydroimidazol-2-one.

Molecular Properties

Compound Name(5R)-4-amino-5-methyl-1,5-dihydroimidazol-2-one
PubChem CID124512317
Molecular FormulaC4H7N3O
Molecular Weight113.12 g/mol
Exact Mass113.06
IUPAC Name(5R)-4-amino-5-methyl-1,5-dihydroimidazol-2-one
SMILESC[C@H]1NC(=O)N=C1N
InChIInChI=1S/C4H7N3O/c1-2-3(5)7-4(8)6-2/h2H,1H3,(H3,5,6,7,8)/t2-/m1/s1
InChIKeyHGHGYCVXQBIEEI-UWTATZPHSA-N
XLogP-0.54
TPSA67.48 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.12
LogP ≤ 5-0.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5R)-4-amino-5-methyl-1,5-dihydroimidazol-2-one?
The IUPAC name of (5R)-4-amino-5-methyl-1,5-dihydroimidazol-2-one (CID 124512317) is (5R)-4-amino-5-methyl-1,5-dihydroimidazol-2-one.
What is the SMILES notation for (5R)-4-amino-5-methyl-1,5-dihydroimidazol-2-one?
The canonical SMILES for (5R)-4-amino-5-methyl-1,5-dihydroimidazol-2-one is C[C@H]1NC(=O)N=C1N.
What is the InChIKey of (5R)-4-amino-5-methyl-1,5-dihydroimidazol-2-one?
The InChIKey is HGHGYCVXQBIEEI-UWTATZPHSA-N. The full InChI is InChI=1S/C4H7N3O/c1-2-3(5)7-4(8)6-2/h2H,1H3,(H3,5,6,7,8)/t2-/m1/s1.
What are the key properties of (5R)-4-amino-5-methyl-1,5-dihydroimidazol-2-one?
(5R)-4-amino-5-methyl-1,5-dihydroimidazol-2-one has a molecular weight of 113.12 g/mol, XLogP of -0.54, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-4-amino-5-methyl-1,5-dihydroimidazol-2-one is sourced from PubChem (CID 124512317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).