2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-1H-pyrimidin-6-one

C11H10N4O2 — CID 136767846

IUPAC2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-1H-pyrimidin-6-one
SMILESO=c1ccnc(N/N=C\c2ccccc2O)[nH]1
InChIInChI=1S/C11H10N4O2/c16-9-4-2-1-3-8(9)7-13-15-11-12-6-5-10(17)14-11/h1-7,16H,(H2,12,14,15,17)/b13-7-
InChIKeyUENOINWBSMDXKU-QPEQYQDCSA-N
MW230.23 g/mol
LogP0.92
Rot. Bonds3

About 2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-1H-pyrimidin-6-one

2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-1H-pyrimidin-6-one (PubChem CID 136767846) has the molecular formula C11H10N4O2 and a molecular weight of 230.23 g/mol. Its IUPAC name is 2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-1H-pyrimidin-6-one
PubChem CID136767846
Molecular FormulaC11H10N4O2
Molecular Weight230.23 g/mol
Exact Mass230.08
IUPAC Name2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-1H-pyrimidin-6-one
SMILESO=c1ccnc(N/N=C\c2ccccc2O)[nH]1
InChIInChI=1S/C11H10N4O2/c16-9-4-2-1-3-8(9)7-13-15-11-12-6-5-10(17)14-11/h1-7,16H,(H2,12,14,15,17)/b13-7-
InChIKeyUENOINWBSMDXKU-QPEQYQDCSA-N
XLogP0.92
TPSA90.37 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.23
LogP ≤ 50.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-1H-pyrimidin-6-one?
The IUPAC name of 2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-1H-pyrimidin-6-one (CID 136767846) is 2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-1H-pyrimidin-6-one.
What is the SMILES notation for 2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-1H-pyrimidin-6-one?
The canonical SMILES for 2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-1H-pyrimidin-6-one is O=c1ccnc(N/N=C\c2ccccc2O)[nH]1.
What is the InChIKey of 2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-1H-pyrimidin-6-one?
The InChIKey is UENOINWBSMDXKU-QPEQYQDCSA-N. The full InChI is InChI=1S/C11H10N4O2/c16-9-4-2-1-3-8(9)7-13-15-11-12-6-5-10(17)14-11/h1-7,16H,(H2,12,14,15,17)/b13-7-.
What are the key properties of 2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-1H-pyrimidin-6-one?
2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-1H-pyrimidin-6-one has a molecular weight of 230.23 g/mol, XLogP of 0.92, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-1H-pyrimidin-6-one is sourced from PubChem (CID 136767846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).