1-methyl-N-(1,2-oxazol-5-ylmethyl)imidazol-2-amine

C8H10N4O — CID 106418901

IUPAC1-methyl-N-(1,2-oxazol-5-ylmethyl)imidazol-2-amine
SMILESCn1ccnc1NCc1ccno1
InChIInChI=1S/C8H10N4O/c1-12-5-4-9-8(12)10-6-7-2-3-11-13-7/h2-5H,6H2,1H3,(H,9,10)
InChIKeyWEHVYFYQAQCBNB-UHFFFAOYSA-N
MW178.19 g/mol
LogP1.02
Rot. Bonds3

About 1-methyl-N-(1,2-oxazol-5-ylmethyl)imidazol-2-amine

1-methyl-N-(1,2-oxazol-5-ylmethyl)imidazol-2-amine (PubChem CID 106418901) has the molecular formula C8H10N4O and a molecular weight of 178.19 g/mol. Its IUPAC name is 1-methyl-N-(1,2-oxazol-5-ylmethyl)imidazol-2-amine.

Molecular Properties

Compound Name1-methyl-N-(1,2-oxazol-5-ylmethyl)imidazol-2-amine
PubChem CID106418901
Molecular FormulaC8H10N4O
Molecular Weight178.19 g/mol
Exact Mass178.09
IUPAC Name1-methyl-N-(1,2-oxazol-5-ylmethyl)imidazol-2-amine
SMILESCn1ccnc1NCc1ccno1
InChIInChI=1S/C8H10N4O/c1-12-5-4-9-8(12)10-6-7-2-3-11-13-7/h2-5H,6H2,1H3,(H,9,10)
InChIKeyWEHVYFYQAQCBNB-UHFFFAOYSA-N
XLogP1.02
TPSA55.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.19
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(4-chlorophenyl)methyl]-1-methylimidazol-2-amine;trihydrochloride
CID 76853743
1-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazol-2-amine
CID 62133823
1-methyl-N-[(2-methyltriazol-4-yl)methyl]imidazol-2-amine
CID 130935235
N-methyl-1-(1,2-oxazol-5-yl)methanamine
CID 23006271
3-N-(1,2-oxazol-5-ylmethyl)pyrazine-2,3-diamine
CID 106424136
2-(2-methylimidazol-1-yl)-N-(1,2-oxazol-5-ylmethyl)ethanamine
CID 106417768
1-(1,2-oxazol-5-yl)-N-(1,2-oxazol-5-ylmethyl)methanamine
CID 165349203
1-methyl-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]imidazol-2-amine
CID 62133277
1-methyl-5-N-(1,2-oxazol-5-ylmethyl)-3-propan-2-ylpyrazole-4,5-diamine
CID 114185816
N-[[3-(aminomethyl)phenyl]methyl]-1-methylimidazol-2-amine
CID 62133080
[3-[[(1-methylimidazol-2-yl)amino]methyl]phenyl]methanol
CID 63312168
5-methyl-N-(1,2-oxazol-5-ylmethyl)-1,3,4-thiadiazol-2-amine
CID 106418955

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(1,2-oxazol-5-ylmethyl)imidazol-2-amine?
The IUPAC name of 1-methyl-N-(1,2-oxazol-5-ylmethyl)imidazol-2-amine (CID 106418901) is 1-methyl-N-(1,2-oxazol-5-ylmethyl)imidazol-2-amine.
What is the SMILES notation for 1-methyl-N-(1,2-oxazol-5-ylmethyl)imidazol-2-amine?
The canonical SMILES for 1-methyl-N-(1,2-oxazol-5-ylmethyl)imidazol-2-amine is Cn1ccnc1NCc1ccno1.
What is the InChIKey of 1-methyl-N-(1,2-oxazol-5-ylmethyl)imidazol-2-amine?
The InChIKey is WEHVYFYQAQCBNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4O/c1-12-5-4-9-8(12)10-6-7-2-3-11-13-7/h2-5H,6H2,1H3,(H,9,10).
What are the key properties of 1-methyl-N-(1,2-oxazol-5-ylmethyl)imidazol-2-amine?
1-methyl-N-(1,2-oxazol-5-ylmethyl)imidazol-2-amine has a molecular weight of 178.19 g/mol, XLogP of 1.02, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(1,2-oxazol-5-ylmethyl)imidazol-2-amine is sourced from PubChem (CID 106418901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).