5-amino-4-(6-methoxy-3-pyridinyl)-3-methyl-4H-imidazol-2-one

C10H12N4O2 — CID 114939049

IUPAC5-amino-4-(6-methoxy-3-pyridinyl)-3-methyl-4H-imidazol-2-one
SMILESCOc1ccc(C2C(N)=NC(=O)N2C)cn1
InChIInChI=1S/C10H12N4O2/c1-14-8(9(11)13-10(14)15)6-3-4-7(16-2)12-5-6/h3-5,8H,1-2H3,(H2,11,13,15)
InChIKeyYJMQEMWZAZXFQP-UHFFFAOYSA-N
MW220.23 g/mol
LogP0.55
Rot. Bonds2

About 5-amino-4-(6-methoxy-3-pyridinyl)-3-methyl-4H-imidazol-2-one

5-amino-4-(6-methoxy-3-pyridinyl)-3-methyl-4H-imidazol-2-one (PubChem CID 114939049) has the molecular formula C10H12N4O2 and a molecular weight of 220.23 g/mol. Its IUPAC name is 5-amino-4-(6-methoxy-3-pyridinyl)-3-methyl-4H-imidazol-2-one.

Molecular Properties

Compound Name5-amino-4-(6-methoxy-3-pyridinyl)-3-methyl-4H-imidazol-2-one
PubChem CID114939049
Molecular FormulaC10H12N4O2
Molecular Weight220.23 g/mol
Exact Mass220.10
IUPAC Name5-amino-4-(6-methoxy-3-pyridinyl)-3-methyl-4H-imidazol-2-one
SMILESCOc1ccc(C2C(N)=NC(=O)N2C)cn1
InChIInChI=1S/C10H12N4O2/c1-14-8(9(11)13-10(14)15)6-3-4-7(16-2)12-5-6/h3-5,8H,1-2H3,(H2,11,13,15)
InChIKeyYJMQEMWZAZXFQP-UHFFFAOYSA-N
XLogP0.55
TPSA80.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.23
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-amino-3-ethyl-4-(6-methoxy-3-pyridinyl)-4H-imidazol-2-one
CID 114939050
5-amino-4-(4-ethoxyphenyl)-3-methyl-4H-imidazol-2-one
CID 79959516
2-amino-4-(6-methoxy-3-pyridinyl)-1,4-dihydroimidazol-5-one
CID 114939075
2-amino-5-(6-methoxy-3-pyridinyl)-1,3-oxazol-4-one
CID 114939096
5-amino-4-[3-(methoxymethyl)phenyl]-3-methyl-4H-imidazol-2-one
CID 79961251
5-amino-4-(2,3-dimethoxyphenyl)-3-methyl-4H-imidazol-2-one
CID 79959271
4-(6-methoxy-3-pyridinyl)azetidin-2-one
CID 114938690
2-(6-methoxy-3-pyridinyl)-1-methyl-5-oxopyrrolidine-3-carboxylic acid
CID 114938524
3-(6-methoxy-3-pyridinyl)-2,2-dimethylcyclopropan-1-amine
CID 130488531
5-cyclopentyl-2-methoxypyridine
CID 102520175
2-(6-methoxy-3-pyridinyl)-1-methylpiperidin-3-amine
CID 114938614
1-cyclopropyl-2-(6-methoxy-3-pyridinyl)pyrrolidin-3-amine
CID 114938624

Frequently Asked Questions

What is the IUPAC name of 5-amino-4-(6-methoxy-3-pyridinyl)-3-methyl-4H-imidazol-2-one?
The IUPAC name of 5-amino-4-(6-methoxy-3-pyridinyl)-3-methyl-4H-imidazol-2-one (CID 114939049) is 5-amino-4-(6-methoxy-3-pyridinyl)-3-methyl-4H-imidazol-2-one.
What is the SMILES notation for 5-amino-4-(6-methoxy-3-pyridinyl)-3-methyl-4H-imidazol-2-one?
The canonical SMILES for 5-amino-4-(6-methoxy-3-pyridinyl)-3-methyl-4H-imidazol-2-one is COc1ccc(C2C(N)=NC(=O)N2C)cn1.
What is the InChIKey of 5-amino-4-(6-methoxy-3-pyridinyl)-3-methyl-4H-imidazol-2-one?
The InChIKey is YJMQEMWZAZXFQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O2/c1-14-8(9(11)13-10(14)15)6-3-4-7(16-2)12-5-6/h3-5,8H,1-2H3,(H2,11,13,15).
What are the key properties of 5-amino-4-(6-methoxy-3-pyridinyl)-3-methyl-4H-imidazol-2-one?
5-amino-4-(6-methoxy-3-pyridinyl)-3-methyl-4H-imidazol-2-one has a molecular weight of 220.23 g/mol, XLogP of 0.55, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-4-(6-methoxy-3-pyridinyl)-3-methyl-4H-imidazol-2-one is sourced from PubChem (CID 114939049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).