1-methyl-5-(5-methyloxolan-2-yl)-4,5-dihydroimidazol-2-amine

C9H17N3O — CID 82839551

IUPAC1-methyl-5-(5-methyloxolan-2-yl)-4,5-dihydroimidazol-2-amine
SMILESCC1CCC(C2CN=C(N)N2C)O1
InChIInChI=1S/C9H17N3O/c1-6-3-4-8(13-6)7-5-11-9(10)12(7)2/h6-8H,3-5H2,1-2H3,(H2,10,11)
InChIKeyQECQESZUTVYFSU-UHFFFAOYSA-N
MW183.25 g/mol
LogP0.18
Rot. Bonds1

About 1-methyl-5-(5-methyloxolan-2-yl)-4,5-dihydroimidazol-2-amine

1-methyl-5-(5-methyloxolan-2-yl)-4,5-dihydroimidazol-2-amine (PubChem CID 82839551) has the molecular formula C9H17N3O and a molecular weight of 183.25 g/mol. Its IUPAC name is 1-methyl-5-(5-methyloxolan-2-yl)-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name1-methyl-5-(5-methyloxolan-2-yl)-4,5-dihydroimidazol-2-amine
PubChem CID82839551
Molecular FormulaC9H17N3O
Molecular Weight183.25 g/mol
Exact Mass183.14
IUPAC Name1-methyl-5-(5-methyloxolan-2-yl)-4,5-dihydroimidazol-2-amine
SMILESCC1CCC(C2CN=C(N)N2C)O1
InChIInChI=1S/C9H17N3O/c1-6-3-4-8(13-6)7-5-11-9(10)12(7)2/h6-8H,3-5H2,1-2H3,(H2,10,11)
InChIKeyQECQESZUTVYFSU-UHFFFAOYSA-N
XLogP0.18
TPSA50.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 50.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-(5-methyloxolan-2-yl)-4,5-dihydroimidazol-2-amine?
The IUPAC name of 1-methyl-5-(5-methyloxolan-2-yl)-4,5-dihydroimidazol-2-amine (CID 82839551) is 1-methyl-5-(5-methyloxolan-2-yl)-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 1-methyl-5-(5-methyloxolan-2-yl)-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 1-methyl-5-(5-methyloxolan-2-yl)-4,5-dihydroimidazol-2-amine is CC1CCC(C2CN=C(N)N2C)O1.
What is the InChIKey of 1-methyl-5-(5-methyloxolan-2-yl)-4,5-dihydroimidazol-2-amine?
The InChIKey is QECQESZUTVYFSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O/c1-6-3-4-8(13-6)7-5-11-9(10)12(7)2/h6-8H,3-5H2,1-2H3,(H2,10,11).
What are the key properties of 1-methyl-5-(5-methyloxolan-2-yl)-4,5-dihydroimidazol-2-amine?
1-methyl-5-(5-methyloxolan-2-yl)-4,5-dihydroimidazol-2-amine has a molecular weight of 183.25 g/mol, XLogP of 0.18, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-(5-methyloxolan-2-yl)-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 82839551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).