(1-hydroxynaphthalen-2-yl)urea

C11H10N2O2 — CID 23171447

IUPAC(1-hydroxynaphthalen-2-yl)urea
SMILESNC(=O)Nc1ccc2ccccc2c1O
InChIInChI=1S/C11H10N2O2/c12-11(15)13-9-6-5-7-3-1-2-4-8(7)10(9)14/h1-6,14H,(H3,12,13,15)
InChIKeyJXKBNNZPWLNIIE-UHFFFAOYSA-N
MW202.21 g/mol
LogP2.04
Rot. Bonds1

About (1-hydroxynaphthalen-2-yl)urea

(1-hydroxynaphthalen-2-yl)urea (PubChem CID 23171447) has the molecular formula C11H10N2O2 and a molecular weight of 202.21 g/mol. Its IUPAC name is (1-hydroxynaphthalen-2-yl)urea.

Molecular Properties

Compound Name(1-hydroxynaphthalen-2-yl)urea
PubChem CID23171447
Molecular FormulaC11H10N2O2
Molecular Weight202.21 g/mol
Exact Mass202.07
IUPAC Name(1-hydroxynaphthalen-2-yl)urea
SMILESNC(=O)Nc1ccc2ccccc2c1O
InChIInChI=1S/C11H10N2O2/c12-11(15)13-9-6-5-7-3-1-2-4-8(7)10(9)14/h1-6,14H,(H3,12,13,15)
InChIKeyJXKBNNZPWLNIIE-UHFFFAOYSA-N
XLogP2.04
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.21
LogP ≤ 52.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1-hydroxynaphthalen-2-yl)urea?
The IUPAC name of (1-hydroxynaphthalen-2-yl)urea (CID 23171447) is (1-hydroxynaphthalen-2-yl)urea.
What is the SMILES notation for (1-hydroxynaphthalen-2-yl)urea?
The canonical SMILES for (1-hydroxynaphthalen-2-yl)urea is NC(=O)Nc1ccc2ccccc2c1O.
What is the InChIKey of (1-hydroxynaphthalen-2-yl)urea?
The InChIKey is JXKBNNZPWLNIIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O2/c12-11(15)13-9-6-5-7-3-1-2-4-8(7)10(9)14/h1-6,14H,(H3,12,13,15).
What are the key properties of (1-hydroxynaphthalen-2-yl)urea?
(1-hydroxynaphthalen-2-yl)urea has a molecular weight of 202.21 g/mol, XLogP of 2.04, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-hydroxynaphthalen-2-yl)urea is sourced from PubChem (CID 23171447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).