1-(2,3-dihydro-1-benzofuran-3-yl)-N-(1-methoxypropan-2-yl)imidazol-2-amine

C15H19N3O2 — CID 106574399

IUPAC1-(2,3-dihydro-1-benzofuran-3-yl)-N-(1-methoxypropan-2-yl)imidazol-2-amine
SMILESCOCC(C)Nc1nccn1C1COc2ccccc21
InChIInChI=1S/C15H19N3O2/c1-11(9-19-2)17-15-16-7-8-18(15)13-10-20-14-6-4-3-5-12(13)14/h3-8,11,13H,9-10H2,1-2H3,(H,16,17)
InChIKeyCMRFTMUKGYUZIO-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.31
Rot. Bonds5

About 1-(2,3-dihydro-1-benzofuran-3-yl)-N-(1-methoxypropan-2-yl)imidazol-2-amine

1-(2,3-dihydro-1-benzofuran-3-yl)-N-(1-methoxypropan-2-yl)imidazol-2-amine (PubChem CID 106574399) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 1-(2,3-dihydro-1-benzofuran-3-yl)-N-(1-methoxypropan-2-yl)imidazol-2-amine.

Molecular Properties

Compound Name1-(2,3-dihydro-1-benzofuran-3-yl)-N-(1-methoxypropan-2-yl)imidazol-2-amine
PubChem CID106574399
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name1-(2,3-dihydro-1-benzofuran-3-yl)-N-(1-methoxypropan-2-yl)imidazol-2-amine
SMILESCOCC(C)Nc1nccn1C1COc2ccccc21
InChIInChI=1S/C15H19N3O2/c1-11(9-19-2)17-15-16-7-8-18(15)13-10-20-14-6-4-3-5-12(13)14/h3-8,11,13H,9-10H2,1-2H3,(H,16,17)
InChIKeyCMRFTMUKGYUZIO-UHFFFAOYSA-N
XLogP2.31
TPSA48.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-cyclohexyl-N-(1-methoxypropan-2-yl)imidazol-2-amine
CID 106554635
N-(1-methoxypropan-2-yl)-1-(1-oxothian-4-yl)imidazol-2-amine
CID 106580407
N,1-bis(1-methoxypropan-2-yl)imidazol-2-amine
CID 106556138
N-(1-methoxypropan-2-yl)-1-[1-(oxolan-3-yl)ethyl]imidazol-2-amine
CID 106582613
1-(2-ethylphenyl)-N-(1-methoxypropan-2-yl)imidazol-2-amine
CID 106559461
N-(1-methoxypropan-2-yl)-1-(1-pyridin-2-ylethyl)imidazol-2-amine
CID 106562209
N-(1-methoxypropan-2-yl)-1-naphthalen-2-ylimidazol-2-amine
CID 106565449
N-(1-methoxypropan-2-yl)-1-(4-phenylbutan-2-yl)imidazol-2-amine
CID 106567227
N-(2,3-dihydro-1-benzofuran-3-yl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
CID 106574403
2-(1,3-benzodioxol-5-yl)-1-(2,3-dihydro-1-benzofuran-3-yl)imidazole
CID 155501108
N-(1-methoxypropan-2-yl)-1-(3-methylbutyl)imidazol-2-amine
CID 106557283
N-(1-methoxypropan-2-yl)-1-(oxolan-2-ylmethyl)imidazol-2-amine
CID 106560082

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1-benzofuran-3-yl)-N-(1-methoxypropan-2-yl)imidazol-2-amine?
The IUPAC name of 1-(2,3-dihydro-1-benzofuran-3-yl)-N-(1-methoxypropan-2-yl)imidazol-2-amine (CID 106574399) is 1-(2,3-dihydro-1-benzofuran-3-yl)-N-(1-methoxypropan-2-yl)imidazol-2-amine.
What is the SMILES notation for 1-(2,3-dihydro-1-benzofuran-3-yl)-N-(1-methoxypropan-2-yl)imidazol-2-amine?
The canonical SMILES for 1-(2,3-dihydro-1-benzofuran-3-yl)-N-(1-methoxypropan-2-yl)imidazol-2-amine is COCC(C)Nc1nccn1C1COc2ccccc21.
What is the InChIKey of 1-(2,3-dihydro-1-benzofuran-3-yl)-N-(1-methoxypropan-2-yl)imidazol-2-amine?
The InChIKey is CMRFTMUKGYUZIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-11(9-19-2)17-15-16-7-8-18(15)13-10-20-14-6-4-3-5-12(13)14/h3-8,11,13H,9-10H2,1-2H3,(H,16,17).
What are the key properties of 1-(2,3-dihydro-1-benzofuran-3-yl)-N-(1-methoxypropan-2-yl)imidazol-2-amine?
1-(2,3-dihydro-1-benzofuran-3-yl)-N-(1-methoxypropan-2-yl)imidazol-2-amine has a molecular weight of 273.34 g/mol, XLogP of 2.31, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1-benzofuran-3-yl)-N-(1-methoxypropan-2-yl)imidazol-2-amine is sourced from PubChem (CID 106574399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).