(3Z)-3-amino-3-hydroxyimino-N-(2-phenylphenyl)propanamide

C15H15N3O2 — CID 43333032

IUPAC(3Z)-3-amino-3-hydroxyimino-N-(2-phenylphenyl)propanamide
SMILESN/C(CC(=O)Nc1ccccc1-c1ccccc1)=N\O
InChIInChI=1S/C15H15N3O2/c16-14(18-20)10-15(19)17-13-9-5-4-8-12(13)11-6-2-1-3-7-11/h1-9,20H,10H2,(H2,16,18)(H,17,19)
InChIKeyRUGKUAYKMDXRLP-UHFFFAOYSA-N
MW269.30 g/mol
LogP2.43
Rot. Bonds4

About (3Z)-3-amino-3-hydroxyimino-N-(2-phenylphenyl)propanamide

(3Z)-3-amino-3-hydroxyimino-N-(2-phenylphenyl)propanamide (PubChem CID 43333032) has the molecular formula C15H15N3O2 and a molecular weight of 269.30 g/mol. Its IUPAC name is (3Z)-3-amino-3-hydroxyimino-N-(2-phenylphenyl)propanamide.

Molecular Properties

Compound Name(3Z)-3-amino-3-hydroxyimino-N-(2-phenylphenyl)propanamide
PubChem CID43333032
Molecular FormulaC15H15N3O2
Molecular Weight269.30 g/mol
Exact Mass269.12
IUPAC Name(3Z)-3-amino-3-hydroxyimino-N-(2-phenylphenyl)propanamide
SMILESN/C(CC(=O)Nc1ccccc1-c1ccccc1)=N\O
InChIInChI=1S/C15H15N3O2/c16-14(18-20)10-15(19)17-13-9-5-4-8-12(13)11-6-2-1-3-7-11/h1-9,20H,10H2,(H2,16,18)(H,17,19)
InChIKeyRUGKUAYKMDXRLP-UHFFFAOYSA-N
XLogP2.43
TPSA87.71 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 52.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_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 (3Z)-3-amino-3-hydroxyimino-N-(2-phenylphenyl)propanamide?
The IUPAC name of (3Z)-3-amino-3-hydroxyimino-N-(2-phenylphenyl)propanamide (CID 43333032) is (3Z)-3-amino-3-hydroxyimino-N-(2-phenylphenyl)propanamide.
What is the SMILES notation for (3Z)-3-amino-3-hydroxyimino-N-(2-phenylphenyl)propanamide?
The canonical SMILES for (3Z)-3-amino-3-hydroxyimino-N-(2-phenylphenyl)propanamide is N/C(CC(=O)Nc1ccccc1-c1ccccc1)=N\O.
What is the InChIKey of (3Z)-3-amino-3-hydroxyimino-N-(2-phenylphenyl)propanamide?
The InChIKey is RUGKUAYKMDXRLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2/c16-14(18-20)10-15(19)17-13-9-5-4-8-12(13)11-6-2-1-3-7-11/h1-9,20H,10H2,(H2,16,18)(H,17,19).
What are the key properties of (3Z)-3-amino-3-hydroxyimino-N-(2-phenylphenyl)propanamide?
(3Z)-3-amino-3-hydroxyimino-N-(2-phenylphenyl)propanamide has a molecular weight of 269.30 g/mol, XLogP of 2.43, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-3-amino-3-hydroxyimino-N-(2-phenylphenyl)propanamide is sourced from PubChem (CID 43333032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).