1-(5-ethylfuran-2-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]methanamine

C13H19N3O — CID 86791588

IUPAC1-(5-ethylfuran-2-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]methanamine
SMILESCCc1ccc(CN(C)Cc2nccn2C)o1
InChIInChI=1S/C13H19N3O/c1-4-11-5-6-12(17-11)9-15(2)10-13-14-7-8-16(13)3/h5-8H,4,9-10H2,1-3H3
InChIKeyULJHSDXTDCLCHX-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.21
Rot. Bonds5

About 1-(5-ethylfuran-2-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]methanamine

1-(5-ethylfuran-2-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]methanamine (PubChem CID 86791588) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is 1-(5-ethylfuran-2-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]methanamine.

Molecular Properties

Compound Name1-(5-ethylfuran-2-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]methanamine
PubChem CID86791588
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name1-(5-ethylfuran-2-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]methanamine
SMILESCCc1ccc(CN(C)Cc2nccn2C)o1
InChIInChI=1S/C13H19N3O/c1-4-11-5-6-12(17-11)9-15(2)10-13-14-7-8-16(13)3/h5-8H,4,9-10H2,1-3H3
InChIKeyULJHSDXTDCLCHX-UHFFFAOYSA-N
XLogP2.21
TPSA34.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

CID 93532
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CID 3073597
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CID 3073603
CID 3073603
CID 3246788
CID 3246788
CID 3154177
CID 3154177
CID 53316510
CID 53316510
CID 130609994
CID 130609994
CID 977250
CID 977250
CID 2885920
CID 2885920
CID 75382649
CID 75382649
CID 13371087
CID 13371087
CID 13371089
CID 13371089

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethylfuran-2-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]methanamine?
The IUPAC name of 1-(5-ethylfuran-2-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]methanamine (CID 86791588) is 1-(5-ethylfuran-2-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]methanamine.
What is the SMILES notation for 1-(5-ethylfuran-2-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]methanamine?
The canonical SMILES for 1-(5-ethylfuran-2-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]methanamine is CCc1ccc(CN(C)Cc2nccn2C)o1.
What is the InChIKey of 1-(5-ethylfuran-2-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]methanamine?
The InChIKey is ULJHSDXTDCLCHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-4-11-5-6-12(17-11)9-15(2)10-13-14-7-8-16(13)3/h5-8H,4,9-10H2,1-3H3.
What are the key properties of 1-(5-ethylfuran-2-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]methanamine?
1-(5-ethylfuran-2-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]methanamine has a molecular weight of 233.31 g/mol, XLogP of 2.21, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethylfuran-2-yl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]methanamine is sourced from PubChem (CID 86791588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).