1-(furan-3-yl)-N-methyl-2-(1-methylbenzimidazol-2-yl)ethanamine

C15H17N3O — CID 79750479

IUPAC1-(furan-3-yl)-N-methyl-2-(1-methylbenzimidazol-2-yl)ethanamine
SMILESCNC(Cc1nc2ccccc2n1C)c1ccoc1
InChIInChI=1S/C15H17N3O/c1-16-13(11-7-8-19-10-11)9-15-17-12-5-3-4-6-14(12)18(15)2/h3-8,10,13,16H,9H2,1-2H3
InChIKeyDTYZQSPCKWKPDB-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.67
Rot. Bonds4

About 1-(furan-3-yl)-N-methyl-2-(1-methylbenzimidazol-2-yl)ethanamine

1-(furan-3-yl)-N-methyl-2-(1-methylbenzimidazol-2-yl)ethanamine (PubChem CID 79750479) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is 1-(furan-3-yl)-N-methyl-2-(1-methylbenzimidazol-2-yl)ethanamine.

Molecular Properties

Compound Name1-(furan-3-yl)-N-methyl-2-(1-methylbenzimidazol-2-yl)ethanamine
PubChem CID79750479
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC Name1-(furan-3-yl)-N-methyl-2-(1-methylbenzimidazol-2-yl)ethanamine
SMILESCNC(Cc1nc2ccccc2n1C)c1ccoc1
InChIInChI=1S/C15H17N3O/c1-16-13(11-7-8-19-10-11)9-15-17-12-5-3-4-6-14(12)18(15)2/h3-8,10,13,16H,9H2,1-2H3
InChIKeyDTYZQSPCKWKPDB-UHFFFAOYSA-N
XLogP2.67
TPSA42.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(furan-3-yl)-2-(1-methylbenzimidazol-2-yl)ethanol
CID 79753671
N-methyl-2-(1-methylbenzimidazol-2-yl)-1-(1-methylpyrazol-4-yl)ethanamine
CID 79750179
1-(2-bromofuran-3-yl)-N-methyl-2-(1-methylbenzimidazol-2-yl)ethanamine
CID 106858090
N-methyl-2-(1-methylbenzimidazol-2-yl)-1-(3-methylimidazol-4-yl)ethanamine
CID 82896332
N-methyl-2-(1-methylbenzimidazol-2-yl)-1-(2-methylpyrimidin-4-yl)ethanamine
CID 115530552
N-methyl-2-(1-methylbenzimidazol-2-yl)-1-(4-methyl-3-pyridinyl)ethanamine
CID 114878188
N-methyl-2-(1-methylbenzimidazol-2-yl)-1-pyrimidin-4-ylethanamine
CID 79750104
N-methyl-2-(1-methylbenzimidazol-2-yl)-1-(thiadiazol-5-yl)ethanamine
CID 105164915
N-methyl-2-(1-methylbenzimidazol-2-yl)-1-(1,2,5-thiadiazol-3-yl)ethanamine
CID 105164834
N-methyl-2-(1-methylbenzimidazol-2-yl)-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine
CID 105007618
N,4-dimethyl-1-(1-methylbenzimidazol-2-yl)pentan-2-amine
CID 79754110
N,5-dimethyl-1-(1-methylbenzimidazol-2-yl)hexan-2-amine
CID 79750546

Frequently Asked Questions

What is the IUPAC name of 1-(furan-3-yl)-N-methyl-2-(1-methylbenzimidazol-2-yl)ethanamine?
The IUPAC name of 1-(furan-3-yl)-N-methyl-2-(1-methylbenzimidazol-2-yl)ethanamine (CID 79750479) is 1-(furan-3-yl)-N-methyl-2-(1-methylbenzimidazol-2-yl)ethanamine.
What is the SMILES notation for 1-(furan-3-yl)-N-methyl-2-(1-methylbenzimidazol-2-yl)ethanamine?
The canonical SMILES for 1-(furan-3-yl)-N-methyl-2-(1-methylbenzimidazol-2-yl)ethanamine is CNC(Cc1nc2ccccc2n1C)c1ccoc1.
What is the InChIKey of 1-(furan-3-yl)-N-methyl-2-(1-methylbenzimidazol-2-yl)ethanamine?
The InChIKey is DTYZQSPCKWKPDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-16-13(11-7-8-19-10-11)9-15-17-12-5-3-4-6-14(12)18(15)2/h3-8,10,13,16H,9H2,1-2H3.
What are the key properties of 1-(furan-3-yl)-N-methyl-2-(1-methylbenzimidazol-2-yl)ethanamine?
1-(furan-3-yl)-N-methyl-2-(1-methylbenzimidazol-2-yl)ethanamine has a molecular weight of 255.32 g/mol, XLogP of 2.67, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-3-yl)-N-methyl-2-(1-methylbenzimidazol-2-yl)ethanamine is sourced from PubChem (CID 79750479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).