4-[[(Z)-but-2-en-2-yl]amino]phenol

C10H13NO — CID 143786933

IUPAC4-[[(Z)-but-2-en-2-yl]amino]phenol
SMILESC/C=C(/C)Nc1ccc(O)cc1
InChIInChI=1S/C10H13NO/c1-3-8(2)11-9-4-6-10(12)7-5-9/h3-7,11-12H,1-2H3/b8-3-
InChIKeyKMSBFKMRECTOOK-BAQGIRSFSA-N
MW163.22 g/mol
LogP2.73
Rot. Bonds2

About 4-[[(Z)-but-2-en-2-yl]amino]phenol

4-[[(Z)-but-2-en-2-yl]amino]phenol (PubChem CID 143786933) has the molecular formula C10H13NO and a molecular weight of 163.22 g/mol. Its IUPAC name is 4-[[(Z)-but-2-en-2-yl]amino]phenol.

Molecular Properties

Compound Name4-[[(Z)-but-2-en-2-yl]amino]phenol
PubChem CID143786933
Molecular FormulaC10H13NO
Molecular Weight163.22 g/mol
Exact Mass163.10
IUPAC Name4-[[(Z)-but-2-en-2-yl]amino]phenol
SMILESC/C=C(/C)Nc1ccc(O)cc1
InChIInChI=1S/C10H13NO/c1-3-8(2)11-9-4-6-10(12)7-5-9/h3-7,11-12H,1-2H3/b8-3-
InChIKeyKMSBFKMRECTOOK-BAQGIRSFSA-N
XLogP2.73
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Related Compounds

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lithium;hydride;N-(4-hydroxyphenyl)acetamide;hexahydrate
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N-(4-hydroxyphenyl)acetamide;N-phenylacetamide
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N-[4-(4-hydroxybenzoyl)phenyl]acetamide
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(Z)-4-[4-[[(Z)-4-oxopent-2-en-2-yl]amino]anilino]pent-3-en-2-one
CID 7707922
(E)-N,N'-bis(4-hydroxyphenyl)but-2-enediamide
CID 5356642
N-(4-hydroxyphenyl)acetamide;piperazine
CID 67107882
3-(4-ethoxyanilino)-N-(4-hydroxyphenyl)but-2-enethioamide
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N-(4-hydroxyphenyl)-2-oxoacetamide
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4-[1-(methylamino)ethenylamino]phenol
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Frequently Asked Questions

What is the IUPAC name of 4-[[(Z)-but-2-en-2-yl]amino]phenol?
The IUPAC name of 4-[[(Z)-but-2-en-2-yl]amino]phenol (CID 143786933) is 4-[[(Z)-but-2-en-2-yl]amino]phenol.
What is the SMILES notation for 4-[[(Z)-but-2-en-2-yl]amino]phenol?
The canonical SMILES for 4-[[(Z)-but-2-en-2-yl]amino]phenol is C/C=C(/C)Nc1ccc(O)cc1.
What is the InChIKey of 4-[[(Z)-but-2-en-2-yl]amino]phenol?
The InChIKey is KMSBFKMRECTOOK-BAQGIRSFSA-N. The full InChI is InChI=1S/C10H13NO/c1-3-8(2)11-9-4-6-10(12)7-5-9/h3-7,11-12H,1-2H3/b8-3-.
What are the key properties of 4-[[(Z)-but-2-en-2-yl]amino]phenol?
4-[[(Z)-but-2-en-2-yl]amino]phenol has a molecular weight of 163.22 g/mol, XLogP of 2.73, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(Z)-but-2-en-2-yl]amino]phenol is sourced from PubChem (CID 143786933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).