N-cyclopropyl-1-(2,2-diethyloxan-4-yl)imidazol-2-amine

C15H25N3O — CID 106578838

IUPACN-cyclopropyl-1-(2,2-diethyloxan-4-yl)imidazol-2-amine
SMILESCCC1(CC)CC(n2ccnc2NC2CC2)CCO1
InChIInChI=1S/C15H25N3O/c1-3-15(4-2)11-13(7-10-19-15)18-9-8-16-14(18)17-12-5-6-12/h8-9,12-13H,3-7,10-11H2,1-2H3,(H,16,17)
InChIKeyHWIHMVKQKNVTEE-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.37
Rot. Bonds5

About N-cyclopropyl-1-(2,2-diethyloxan-4-yl)imidazol-2-amine

N-cyclopropyl-1-(2,2-diethyloxan-4-yl)imidazol-2-amine (PubChem CID 106578838) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is N-cyclopropyl-1-(2,2-diethyloxan-4-yl)imidazol-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-1-(2,2-diethyloxan-4-yl)imidazol-2-amine
PubChem CID106578838
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC NameN-cyclopropyl-1-(2,2-diethyloxan-4-yl)imidazol-2-amine
SMILESCCC1(CC)CC(n2ccnc2NC2CC2)CCO1
InChIInChI=1S/C15H25N3O/c1-3-15(4-2)11-13(7-10-19-15)18-9-8-16-14(18)17-12-5-6-12/h8-9,12-13H,3-7,10-11H2,1-2H3,(H,16,17)
InChIKeyHWIHMVKQKNVTEE-UHFFFAOYSA-N
XLogP3.37
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-(2,2-diethyloxan-4-yl)imidazol-2-amine?
The IUPAC name of N-cyclopropyl-1-(2,2-diethyloxan-4-yl)imidazol-2-amine (CID 106578838) is N-cyclopropyl-1-(2,2-diethyloxan-4-yl)imidazol-2-amine.
What is the SMILES notation for N-cyclopropyl-1-(2,2-diethyloxan-4-yl)imidazol-2-amine?
The canonical SMILES for N-cyclopropyl-1-(2,2-diethyloxan-4-yl)imidazol-2-amine is CCC1(CC)CC(n2ccnc2NC2CC2)CCO1.
What is the InChIKey of N-cyclopropyl-1-(2,2-diethyloxan-4-yl)imidazol-2-amine?
The InChIKey is HWIHMVKQKNVTEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-3-15(4-2)11-13(7-10-19-15)18-9-8-16-14(18)17-12-5-6-12/h8-9,12-13H,3-7,10-11H2,1-2H3,(H,16,17).
What are the key properties of N-cyclopropyl-1-(2,2-diethyloxan-4-yl)imidazol-2-amine?
N-cyclopropyl-1-(2,2-diethyloxan-4-yl)imidazol-2-amine has a molecular weight of 263.38 g/mol, XLogP of 3.37, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-(2,2-diethyloxan-4-yl)imidazol-2-amine is sourced from PubChem (CID 106578838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).