3-hydroxy-N'-(2-phenylacetyl)naphthalene-2-carbohydrazide

C19H16N2O3 — CID 27227626

IUPAC3-hydroxy-N'-(2-phenylacetyl)naphthalene-2-carbohydrazide
SMILESO=C(Cc1ccccc1)NNC(=O)c1cc2ccccc2cc1O
InChIInChI=1S/C19H16N2O3/c22-17-12-15-9-5-4-8-14(15)11-16(17)19(24)21-20-18(23)10-13-6-2-1-3-7-13/h1-9,11-12,22H,10H2,(H,20,23)(H,21,24)
InChIKeyBAICTXIIUGTUDK-UHFFFAOYSA-N
MW320.35 g/mol
LogP2.55
Rot. Bonds3

About 3-hydroxy-N'-(2-phenylacetyl)naphthalene-2-carbohydrazide

3-hydroxy-N'-(2-phenylacetyl)naphthalene-2-carbohydrazide (PubChem CID 27227626) has the molecular formula C19H16N2O3 and a molecular weight of 320.35 g/mol. Its IUPAC name is 3-hydroxy-N'-(2-phenylacetyl)naphthalene-2-carbohydrazide.

Molecular Properties

Compound Name3-hydroxy-N'-(2-phenylacetyl)naphthalene-2-carbohydrazide
PubChem CID27227626
Molecular FormulaC19H16N2O3
Molecular Weight320.35 g/mol
Exact Mass320.12
IUPAC Name3-hydroxy-N'-(2-phenylacetyl)naphthalene-2-carbohydrazide
SMILESO=C(Cc1ccccc1)NNC(=O)c1cc2ccccc2cc1O
InChIInChI=1S/C19H16N2O3/c22-17-12-15-9-5-4-8-14(15)11-16(17)19(24)21-20-18(23)10-13-6-2-1-3-7-13/h1-9,11-12,22H,10H2,(H,20,23)(H,21,24)
InChIKeyBAICTXIIUGTUDK-UHFFFAOYSA-N
XLogP2.55
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.35
LogP ≤ 52.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N'-(2-phenylacetyl)naphthalene-2-carbohydrazide?
The IUPAC name of 3-hydroxy-N'-(2-phenylacetyl)naphthalene-2-carbohydrazide (CID 27227626) is 3-hydroxy-N'-(2-phenylacetyl)naphthalene-2-carbohydrazide.
What is the SMILES notation for 3-hydroxy-N'-(2-phenylacetyl)naphthalene-2-carbohydrazide?
The canonical SMILES for 3-hydroxy-N'-(2-phenylacetyl)naphthalene-2-carbohydrazide is O=C(Cc1ccccc1)NNC(=O)c1cc2ccccc2cc1O.
What is the InChIKey of 3-hydroxy-N'-(2-phenylacetyl)naphthalene-2-carbohydrazide?
The InChIKey is BAICTXIIUGTUDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O3/c22-17-12-15-9-5-4-8-14(15)11-16(17)19(24)21-20-18(23)10-13-6-2-1-3-7-13/h1-9,11-12,22H,10H2,(H,20,23)(H,21,24).
What are the key properties of 3-hydroxy-N'-(2-phenylacetyl)naphthalene-2-carbohydrazide?
3-hydroxy-N'-(2-phenylacetyl)naphthalene-2-carbohydrazide has a molecular weight of 320.35 g/mol, XLogP of 2.55, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N'-(2-phenylacetyl)naphthalene-2-carbohydrazide is sourced from PubChem (CID 27227626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).