5-benzylfuran-2-amine

C11H11NO — CID 68934924

IUPAC5-benzylfuran-2-amine
SMILESNc1ccc(Cc2ccccc2)o1
InChIInChI=1S/C11H11NO/c12-11-7-6-10(13-11)8-9-4-2-1-3-5-9/h1-7H,8,12H2
InChIKeyKWLNOKLHYLKCCI-UHFFFAOYSA-N
MW173.22 g/mol
LogP2.45
Rot. Bonds2

About 5-benzylfuran-2-amine

5-benzylfuran-2-amine (PubChem CID 68934924) has the molecular formula C11H11NO and a molecular weight of 173.22 g/mol. Its IUPAC name is 5-benzylfuran-2-amine.

Molecular Properties

Compound Name5-benzylfuran-2-amine
PubChem CID68934924
Molecular FormulaC11H11NO
Molecular Weight173.22 g/mol
Exact Mass173.08
IUPAC Name5-benzylfuran-2-amine
SMILESNc1ccc(Cc2ccccc2)o1
InChIInChI=1S/C11H11NO/c12-11-7-6-10(13-11)8-9-4-2-1-3-5-9/h1-7H,8,12H2
InChIKeyKWLNOKLHYLKCCI-UHFFFAOYSA-N
XLogP2.45
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.22
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

phenyl(113C)methylbenzene
CID 11194569
benzylbenzene;ethane;methanamine
CID 54117827
2-[(2-amino-5-benzylphenyl)diselanyl]-4-benzylaniline
CID 10052449
5-benzyl-2-chloroaniline
CID 39243776
2-amino-N-[(5-benzylfuran-2-yl)methyl]pyridine-3-carboxamide
CID 23130667
potassium;benzylbenzene;hydride
CID 173011788
5-benzyl-1,2-oxazole
CID 21193134
5,6-dibenzylpyridine-2,3,4-triamine
CID 19038977
4-benzylnaphthalene-1,8-diamine
CID 19896349
2-amino-5-benzylbenzoic acid
CID 23538086
(5-benzylfuran-2-yl) 2-nitrosobutanoate
CID 54398216
5-benzyl-[1,2,4]triazolo[4,3-a]pyridine-3,6-diamine
CID 121249932

Frequently Asked Questions

What is the IUPAC name of 5-benzylfuran-2-amine?
The IUPAC name of 5-benzylfuran-2-amine (CID 68934924) is 5-benzylfuran-2-amine.
What is the SMILES notation for 5-benzylfuran-2-amine?
The canonical SMILES for 5-benzylfuran-2-amine is Nc1ccc(Cc2ccccc2)o1.
What is the InChIKey of 5-benzylfuran-2-amine?
The InChIKey is KWLNOKLHYLKCCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO/c12-11-7-6-10(13-11)8-9-4-2-1-3-5-9/h1-7H,8,12H2.
What are the key properties of 5-benzylfuran-2-amine?
5-benzylfuran-2-amine has a molecular weight of 173.22 g/mol, XLogP of 2.45, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-benzylfuran-2-amine is sourced from PubChem (CID 68934924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).