2-[[(E)-but-2-enylidene]amino]phenol

C10H11NO — CID 24796549

IUPAC2-[[(E)-but-2-enylidene]amino]phenol
SMILESC/C=C/C=N/c1ccccc1O
InChIInChI=1S/C10H11NO/c1-2-3-8-11-9-6-4-5-7-10(9)12/h2-8,12H,1H3/b3-2+,11-8+
InChIKeyZFHRVAPMARMSTO-FWTOVJONSA-N
MW161.20 g/mol
LogP2.67
Rot. Bonds2

About 2-[[(E)-but-2-enylidene]amino]phenol

2-[[(E)-but-2-enylidene]amino]phenol (PubChem CID 24796549) has the molecular formula C10H11NO and a molecular weight of 161.20 g/mol. Its IUPAC name is 2-[[(E)-but-2-enylidene]amino]phenol.

Molecular Properties

Compound Name2-[[(E)-but-2-enylidene]amino]phenol
PubChem CID24796549
Molecular FormulaC10H11NO
Molecular Weight161.20 g/mol
Exact Mass161.08
IUPAC Name2-[[(E)-but-2-enylidene]amino]phenol
SMILESC/C=C/C=N/c1ccccc1O
InChIInChI=1S/C10H11NO/c1-2-3-8-11-9-6-4-5-7-10(9)12/h2-8,12H,1H3/b3-2+,11-8+
InChIKeyZFHRVAPMARMSTO-FWTOVJONSA-N
XLogP2.67
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_phenol_A(3)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

2-[[(2E,4E,6E)-deca-2,4,6-trienylidene]amino]phenol
CID 142884962
4-[[(E)-but-2-enylidene]amino]phenol
CID 131246971
(1Z,3Z)-1-[2-[[(Z)-but-2-enylidene]amino]phenyl]hexa-1,3-dien-1-amine
CID 144942988
2-(nonylideneamino)phenol
CID 100954410
2-[(2-methylphenyl)methylideneamino]phenol
CID 11009223
copper 2-[(2-hydroxyphenyl)iminomethyl]phenol
CID 135534570
(E)-N-(2,6-dimethylphenyl)but-2-en-1-imine
CID 12818328
zinc 2-[(2-hydroxyphenyl)iminomethyl]phenol
CID 135534569
2-[(3,3-dimethylpyrrol-2-yl)methylideneamino]phenol
CID 136683436
N,N'-bis(2-hydroxyphenyl)methanimidamide
CID 15496732
2-penta-1,3-dienylphenol
CID 141162259
N-(4-methylphenyl)but-2-en-1-imine
CID 71345693

Frequently Asked Questions

What is the IUPAC name of 2-[[(E)-but-2-enylidene]amino]phenol?
The IUPAC name of 2-[[(E)-but-2-enylidene]amino]phenol (CID 24796549) is 2-[[(E)-but-2-enylidene]amino]phenol.
What is the SMILES notation for 2-[[(E)-but-2-enylidene]amino]phenol?
The canonical SMILES for 2-[[(E)-but-2-enylidene]amino]phenol is C/C=C/C=N/c1ccccc1O.
What is the InChIKey of 2-[[(E)-but-2-enylidene]amino]phenol?
The InChIKey is ZFHRVAPMARMSTO-FWTOVJONSA-N. The full InChI is InChI=1S/C10H11NO/c1-2-3-8-11-9-6-4-5-7-10(9)12/h2-8,12H,1H3/b3-2+,11-8+.
What are the key properties of 2-[[(E)-but-2-enylidene]amino]phenol?
2-[[(E)-but-2-enylidene]amino]phenol has a molecular weight of 161.20 g/mol, XLogP of 2.67, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(E)-but-2-enylidene]amino]phenol is sourced from PubChem (CID 24796549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).