4-methyl-1-(oxan-4-ylmethyl)imidazol-2-amine

C10H17N3O — CID 106572445

IUPAC4-methyl-1-(oxan-4-ylmethyl)imidazol-2-amine
SMILESCc1cn(CC2CCOCC2)c(N)n1
InChIInChI=1S/C10H17N3O/c1-8-6-13(10(11)12-8)7-9-2-4-14-5-3-9/h6,9H,2-5,7H2,1H3,(H2,11,12)
InChIKeyUUVSXDLUSFQZCO-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.20
Rot. Bonds2

About 4-methyl-1-(oxan-4-ylmethyl)imidazol-2-amine

4-methyl-1-(oxan-4-ylmethyl)imidazol-2-amine (PubChem CID 106572445) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 4-methyl-1-(oxan-4-ylmethyl)imidazol-2-amine.

Molecular Properties

Compound Name4-methyl-1-(oxan-4-ylmethyl)imidazol-2-amine
PubChem CID106572445
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name4-methyl-1-(oxan-4-ylmethyl)imidazol-2-amine
SMILESCc1cn(CC2CCOCC2)c(N)n1
InChIInChI=1S/C10H17N3O/c1-8-6-13(10(11)12-8)7-9-2-4-14-5-3-9/h6,9H,2-5,7H2,1H3,(H2,11,12)
InChIKeyUUVSXDLUSFQZCO-UHFFFAOYSA-N
XLogP1.20
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(oxan-4-ylmethyl)imidazol-2-amine?
The IUPAC name of 4-methyl-1-(oxan-4-ylmethyl)imidazol-2-amine (CID 106572445) is 4-methyl-1-(oxan-4-ylmethyl)imidazol-2-amine.
What is the SMILES notation for 4-methyl-1-(oxan-4-ylmethyl)imidazol-2-amine?
The canonical SMILES for 4-methyl-1-(oxan-4-ylmethyl)imidazol-2-amine is Cc1cn(CC2CCOCC2)c(N)n1.
What is the InChIKey of 4-methyl-1-(oxan-4-ylmethyl)imidazol-2-amine?
The InChIKey is UUVSXDLUSFQZCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-8-6-13(10(11)12-8)7-9-2-4-14-5-3-9/h6,9H,2-5,7H2,1H3,(H2,11,12).
What are the key properties of 4-methyl-1-(oxan-4-ylmethyl)imidazol-2-amine?
4-methyl-1-(oxan-4-ylmethyl)imidazol-2-amine has a molecular weight of 195.27 g/mol, XLogP of 1.20, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(oxan-4-ylmethyl)imidazol-2-amine is sourced from PubChem (CID 106572445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).