2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-3-methyl-6-propan-2-ylphenol

C17H20N2O2 — CID 136910735

IUPAC2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-3-methyl-6-propan-2-ylphenol
SMILESCc1ccc(C(C)C)c(O)c1N/N=C\c1ccccc1O
InChIInChI=1S/C17H20N2O2/c1-11(2)14-9-8-12(3)16(17(14)21)19-18-10-13-6-4-5-7-15(13)20/h4-11,19-21H,1-3H3/b18-10-
InChIKeyJCCSZGWZTXUPLC-ZDLGFXPLSA-N
MW284.36 g/mol
LogP3.98
Rot. Bonds4

About 2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-3-methyl-6-propan-2-ylphenol

2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-3-methyl-6-propan-2-ylphenol (PubChem CID 136910735) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-3-methyl-6-propan-2-ylphenol.

Molecular Properties

Compound Name2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-3-methyl-6-propan-2-ylphenol
PubChem CID136910735
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-3-methyl-6-propan-2-ylphenol
SMILESCc1ccc(C(C)C)c(O)c1N/N=C\c1ccccc1O
InChIInChI=1S/C17H20N2O2/c1-11(2)14-9-8-12(3)16(17(14)21)19-18-10-13-6-4-5-7-15(13)20/h4-11,19-21H,1-3H3/b18-10-
InChIKeyJCCSZGWZTXUPLC-ZDLGFXPLSA-N
XLogP3.98
TPSA64.85 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'catechol', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[(Z)-[(2,3,4,5,6-pentafluorophenyl)hydrazinylidene]methyl]phenol
CID 136672918
1,3-bis[(2-hydroxyphenyl)methylideneamino]thiourea
CID 3446799
(2S)-2-hydroxy-N-[(E)-(2-hydroxyphenyl)methylideneamino]propanamide
CID 135688184
2-[(E)-[(2,8-dimethylquinolin-4-yl)hydrazinylidene]methyl]phenol
CID 135537322
2-[(E)-[(4-amino-5-methyl-1,2,4-triazol-3-yl)hydrazinylidene]methyl]phenol
CID 135439758
2-[(E)-[(4,5-dimethyl-1,3-thiazol-2-yl)hydrazinylidene]methyl]phenol
CID 135588614
2-[[(4-amino-5-methyl-1,2,4-triazol-3-yl)hydrazinylidene]methyl]phenol
CID 3889042
2-(4-chloro-5-methyl-2-propan-2-ylphenoxy)-N-[(E)-(2-hydroxyphenyl)methylideneamino]acetamide
CID 135716692
2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-4-propan-2-yl-1H-pyrimidin-6-one
CID 136787959
2-[(2E)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-5-methyl-1H-pyrimidin-6-one
CID 135454395
2-[(E)-[(Z)-(2-methylphenyl)methylidenehydrazinylidene]methyl]phenol
CID 135478768
2-[[(4-amino-5-methyl-1,2,4-triazol-3-yl)hydrazinylidene]methyl]phenol;hydrochloride
CID 136666616

Frequently Asked Questions

What is the IUPAC name of 2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-3-methyl-6-propan-2-ylphenol?
The IUPAC name of 2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-3-methyl-6-propan-2-ylphenol (CID 136910735) is 2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-3-methyl-6-propan-2-ylphenol.
What is the SMILES notation for 2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-3-methyl-6-propan-2-ylphenol?
The canonical SMILES for 2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-3-methyl-6-propan-2-ylphenol is Cc1ccc(C(C)C)c(O)c1N/N=C\c1ccccc1O.
What is the InChIKey of 2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-3-methyl-6-propan-2-ylphenol?
The InChIKey is JCCSZGWZTXUPLC-ZDLGFXPLSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-11(2)14-9-8-12(3)16(17(14)21)19-18-10-13-6-4-5-7-15(13)20/h4-11,19-21H,1-3H3/b18-10-.
What are the key properties of 2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-3-methyl-6-propan-2-ylphenol?
2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-3-methyl-6-propan-2-ylphenol has a molecular weight of 284.36 g/mol, XLogP of 3.98, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-3-methyl-6-propan-2-ylphenol is sourced from PubChem (CID 136910735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).