2-amino-4-(2-methoxy-2-methylpropyl)-1,4-dihydroimidazol-5-one

C8H15N3O2 — CID 106676684

IUPAC2-amino-4-(2-methoxy-2-methylpropyl)-1,4-dihydroimidazol-5-one
SMILESCOC(C)(C)CC1N=C(N)NC1=O
InChIInChI=1S/C8H15N3O2/c1-8(2,13-3)4-5-6(12)11-7(9)10-5/h5H,4H2,1-3H3,(H3,9,10,11,12)
InChIKeyPGOFJKDPTWLZBZ-UHFFFAOYSA-N
MW185.23 g/mol
LogP-0.39
Rot. Bonds3

About 2-amino-4-(2-methoxy-2-methylpropyl)-1,4-dihydroimidazol-5-one

2-amino-4-(2-methoxy-2-methylpropyl)-1,4-dihydroimidazol-5-one (PubChem CID 106676684) has the molecular formula C8H15N3O2 and a molecular weight of 185.23 g/mol. Its IUPAC name is 2-amino-4-(2-methoxy-2-methylpropyl)-1,4-dihydroimidazol-5-one.

Molecular Properties

Compound Name2-amino-4-(2-methoxy-2-methylpropyl)-1,4-dihydroimidazol-5-one
PubChem CID106676684
Molecular FormulaC8H15N3O2
Molecular Weight185.23 g/mol
Exact Mass185.12
IUPAC Name2-amino-4-(2-methoxy-2-methylpropyl)-1,4-dihydroimidazol-5-one
SMILESCOC(C)(C)CC1N=C(N)NC1=O
InChIInChI=1S/C8H15N3O2/c1-8(2,13-3)4-5-6(12)11-7(9)10-5/h5H,4H2,1-3H3,(H3,9,10,11,12)
InChIKeyPGOFJKDPTWLZBZ-UHFFFAOYSA-N
XLogP-0.39
TPSA76.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 5-0.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-4-(methoxymethyl)-1,4-dihydroimidazol-5-one
CID 83136823
2-amino-4-(sulfanylmethyl)-1,4-dihydroimidazol-5-one
CID 10154117
2-amino-4-prop-2-enyl-1,4-dihydroimidazol-5-one
CID 83136998
4-ethyl-2-(2-methoxypropan-2-yl)-1,4-dihydroimidazol-5-one
CID 106952766
2-amino-4-(2-methoxy-2-methylpropyl)-4-methyl-1H-imidazol-5-one
CID 82996623
2-amino-4-[(4-nitrophenyl)methyl]-1,4-dihydroimidazol-5-one
CID 11128220
5-(2-methoxy-2-methylpropyl)-2-propyliminoimidazolidin-4-one
CID 136766553
2-(3-methoxypentan-3-yl)-4-propyl-1,4-dihydroimidazol-5-one
CID 106952802
2-amino-4-(3,4,5-trimethoxyphenyl)-1,4-dihydroimidazol-5-one
CID 82996110
2-amino-4-(6-methoxy-3-pyridinyl)-1,4-dihydroimidazol-5-one
CID 114939075
2-amino-4-(5-tert-butylthiophen-2-yl)-1,4-dihydroimidazol-5-one
CID 82997357
2-(2-methoxy-2-methylpropyl)oxirane
CID 18626422

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-(2-methoxy-2-methylpropyl)-1,4-dihydroimidazol-5-one?
The IUPAC name of 2-amino-4-(2-methoxy-2-methylpropyl)-1,4-dihydroimidazol-5-one (CID 106676684) is 2-amino-4-(2-methoxy-2-methylpropyl)-1,4-dihydroimidazol-5-one.
What is the SMILES notation for 2-amino-4-(2-methoxy-2-methylpropyl)-1,4-dihydroimidazol-5-one?
The canonical SMILES for 2-amino-4-(2-methoxy-2-methylpropyl)-1,4-dihydroimidazol-5-one is COC(C)(C)CC1N=C(N)NC1=O.
What is the InChIKey of 2-amino-4-(2-methoxy-2-methylpropyl)-1,4-dihydroimidazol-5-one?
The InChIKey is PGOFJKDPTWLZBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O2/c1-8(2,13-3)4-5-6(12)11-7(9)10-5/h5H,4H2,1-3H3,(H3,9,10,11,12).
What are the key properties of 2-amino-4-(2-methoxy-2-methylpropyl)-1,4-dihydroimidazol-5-one?
2-amino-4-(2-methoxy-2-methylpropyl)-1,4-dihydroimidazol-5-one has a molecular weight of 185.23 g/mol, XLogP of -0.39, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-(2-methoxy-2-methylpropyl)-1,4-dihydroimidazol-5-one is sourced from PubChem (CID 106676684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).