anilino(furan-2-yl)methanol

C11H11NO2 — CID 143292657

IUPACanilino(furan-2-yl)methanol
SMILESOC(Nc1ccccc1)c1ccco1
InChIInChI=1S/C11H11NO2/c13-11(10-7-4-8-14-10)12-9-5-2-1-3-6-9/h1-8,11-13H
InChIKeyNSTBFDGTNCMKTF-UHFFFAOYSA-N
MW189.21 g/mol
LogP2.38
Rot. Bonds3

About anilino(furan-2-yl)methanol

anilino(furan-2-yl)methanol (PubChem CID 143292657) has the molecular formula C11H11NO2 and a molecular weight of 189.21 g/mol. Its IUPAC name is anilino(furan-2-yl)methanol.

Molecular Properties

Compound Nameanilino(furan-2-yl)methanol
PubChem CID143292657
Molecular FormulaC11H11NO2
Molecular Weight189.21 g/mol
Exact Mass189.08
IUPAC Nameanilino(furan-2-yl)methanol
SMILESOC(Nc1ccccc1)c1ccco1
InChIInChI=1S/C11H11NO2/c13-11(10-7-4-8-14-10)12-9-5-2-1-3-6-9/h1-8,11-13H
InChIKeyNSTBFDGTNCMKTF-UHFFFAOYSA-N
XLogP2.38
TPSA45.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.21
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

3-anilino-3-(furan-2-yl)propan-1-ol
CID 83821736
N-[(1S)-1-(furan-2-yl)prop-2-enyl]aniline
CID 102087779
N-[1-(furan-2-yl)-3-methylbut-3-enyl]aniline
CID 3147174
3-(furan-2-yl)-3-hydroxy-N-phenylpropanamide
CID 78165450
(1S,2S)-2-anilino-1,2-diphenylethanol
CID 1236280
1-(furan-2-yl)-2,2-diphenylethanol
CID 63947549
furan-2-yl-(2-phenylphenyl)methanol
CID 172878097
1,3-bis(furan-2-yl)propane-1,2,3-triol
CID 70525722
2,2,2-trichloro-1-(furan-2-yl)ethanol
CID 11356360
2-[1-(furan-2-yl)ethyl]-1-phenylguanidine
CID 55064252
1-[(1R)-1-(furan-2-yl)ethyl]-3-phenylurea
CID 51473393
1-[(1S)-1-(furan-2-yl)ethyl]-3-phenylurea
CID 51473392

Frequently Asked Questions

What is the IUPAC name of anilino(furan-2-yl)methanol?
The IUPAC name of anilino(furan-2-yl)methanol (CID 143292657) is anilino(furan-2-yl)methanol.
What is the SMILES notation for anilino(furan-2-yl)methanol?
The canonical SMILES for anilino(furan-2-yl)methanol is OC(Nc1ccccc1)c1ccco1.
What is the InChIKey of anilino(furan-2-yl)methanol?
The InChIKey is NSTBFDGTNCMKTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO2/c13-11(10-7-4-8-14-10)12-9-5-2-1-3-6-9/h1-8,11-13H.
What are the key properties of anilino(furan-2-yl)methanol?
anilino(furan-2-yl)methanol has a molecular weight of 189.21 g/mol, XLogP of 2.38, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for anilino(furan-2-yl)methanol is sourced from PubChem (CID 143292657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).