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

C15H21N3O — CID 82839109

IUPAC1-benzyl-5-(5-methyloxolan-2-yl)-4,5-dihydroimidazol-2-amine
SMILESCC1CCC(C2CN=C(N)N2Cc2ccccc2)O1
InChIInChI=1S/C15H21N3O/c1-11-7-8-14(19-11)13-9-17-15(16)18(13)10-12-5-3-2-4-6-12/h2-6,11,13-14H,7-10H2,1H3,(H2,16,17)
InChIKeyYYNQKRQUMFFABG-UHFFFAOYSA-N
MW259.35 g/mol
LogP1.75
Rot. Bonds3

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

1-benzyl-5-(5-methyloxolan-2-yl)-4,5-dihydroimidazol-2-amine (PubChem CID 82839109) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 1-benzyl-5-(5-methyloxolan-2-yl)-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name1-benzyl-5-(5-methyloxolan-2-yl)-4,5-dihydroimidazol-2-amine
PubChem CID82839109
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name1-benzyl-5-(5-methyloxolan-2-yl)-4,5-dihydroimidazol-2-amine
SMILESCC1CCC(C2CN=C(N)N2Cc2ccccc2)O1
InChIInChI=1S/C15H21N3O/c1-11-7-8-14(19-11)13-9-17-15(16)18(13)10-12-5-3-2-4-6-12/h2-6,11,13-14H,7-10H2,1H3,(H2,16,17)
InChIKeyYYNQKRQUMFFABG-UHFFFAOYSA-N
XLogP1.75
TPSA50.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-amino-3-benzyl-4-(5-methyloxolan-2-yl)-4H-imidazol-2-one
CID 82838803
1-benzyl-5-pentan-2-yl-4,5-dihydroimidazol-2-amine
CID 79506049
1-benzyl-5-thiophen-2-yl-4,5-dihydroimidazol-2-amine
CID 79506524
1-benzyl-5-(2,4-dimethylphenyl)-4,5-dihydroimidazol-2-amine
CID 79498143
5-(azidomethyl)-1-benzyl-4,5-dihydroimidazol-2-amine
CID 79505950
(5S)-5-benzyl-1-(2,2-dimethylpropyl)-4,5-dihydroimidazol-2-amine
CID 23640797
1-benzyl-5-(3-methoxyphenyl)-4,5-dihydroimidazol-2-amine
CID 79498168
1-benzyl-5-(4,5-dibromothiophen-2-yl)-4,5-dihydroimidazol-2-amine
CID 102845733
(5S)-5-benzyl-1-butyl-4,5-dihydroimidazol-2-amine
CID 23640807
5-(5-methyloxolan-2-yl)-4,5-dihydro-1H-imidazol-2-amine
CID 82839276
3-benzyl-4-methyl-4H-quinazolin-2-amine
CID 12628950
(5S)-1-benzyl-5-[(2R)-oxiran-2-yl]pyrrolidin-2-one
CID 18641408

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-5-(5-methyloxolan-2-yl)-4,5-dihydroimidazol-2-amine?
The IUPAC name of 1-benzyl-5-(5-methyloxolan-2-yl)-4,5-dihydroimidazol-2-amine (CID 82839109) is 1-benzyl-5-(5-methyloxolan-2-yl)-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 1-benzyl-5-(5-methyloxolan-2-yl)-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 1-benzyl-5-(5-methyloxolan-2-yl)-4,5-dihydroimidazol-2-amine is CC1CCC(C2CN=C(N)N2Cc2ccccc2)O1.
What is the InChIKey of 1-benzyl-5-(5-methyloxolan-2-yl)-4,5-dihydroimidazol-2-amine?
The InChIKey is YYNQKRQUMFFABG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-11-7-8-14(19-11)13-9-17-15(16)18(13)10-12-5-3-2-4-6-12/h2-6,11,13-14H,7-10H2,1H3,(H2,16,17).
What are the key properties of 1-benzyl-5-(5-methyloxolan-2-yl)-4,5-dihydroimidazol-2-amine?
1-benzyl-5-(5-methyloxolan-2-yl)-4,5-dihydroimidazol-2-amine has a molecular weight of 259.35 g/mol, XLogP of 1.75, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-5-(5-methyloxolan-2-yl)-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 82839109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).